CAS RN: 103687-06-5
CAS Name: 3-[(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)methyl]-2-(4-ethoxyphenyl)imino-4-thiazolidinone
OPENEYE Name: 3-[(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)methyl]-2-(4-ethoxyphenyl)imino-thiazolidin-4-one
IUPAC Name: 3-[(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)methyl]-2-(4-ethoxyphenyl)imino-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-[(2-chloranyl-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)methyl]-2-(4-ethoxyphenyl)imino-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C32H26ClN5O2S
MOLECULAR WEIGHT: 580.09914
SMILES: CCOC1=CC=C(C=C1)N=C2N(C(=O)CS2)CC3=NC4=CC=CC=C4NC(=C5C=C(C=CC5=N3)Cl)C6=CC=CC=C6
Structure:
CAS RN: 103687-07-6
CAS Name: 3-[2-(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)ethyl]-2-(4-ethoxyphenyl)imino-4-thiazolidinone
OPENEYE Name: 3-[2-(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)ethyl]-2-(4-ethoxyphenyl)imino-thiazolidin-4-one
IUPAC Name: 3-[2-(2-chloro-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)ethyl]-2-(4-ethoxyphenyl)imino-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 3-[2-(2-chloranyl-13-phenyl-12H-benzo[d][1,3,7]benzotriazonin-6-yl)ethyl]-2-(4-ethoxyphenyl)imino-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C33H28ClN5O2S
MOLECULAR WEIGHT: 594.12572
SMILES: CCOC1=CC=C(C=C1)N=C2N(C(=O)CS2)CCC3=NC4=CC=CC=C4NC(=C5C=C(C=CC5=N3)Cl)C6=CC=CC=C6
Structure:
CAS RN: 102612-91-9
CAS Name: disodium 6-(4-oxo-2-thiazolidinyl)hexanoate pentahydrate
OPENEYE Name: disodium 6-(4-oxothiazolidin-2-yl)hexanoate pentahydrate
IUPAC Name: disodium 6-(4-oxo-1,3-thiazolidin-2-yl)hexanoate pentahydrate
SYSTEMATIC NAME: disodium 6-(4-oxidanylidene-1,3-thiazolidin-2-yl)hexanoate pentahydrate
MOLECULAR FORMULA: C18H38N2Na2O11S2
MOLECULAR WEIGHT: 568.61066
SMILES: C1C(=O)NC(S1)CCCCCC(=O)[O-].C1C(=O)NC(S1)CCCCCC(=O)[O-].O.O.O.O.O.[Na+].[Na+]
Structure:
CAS RN: 95533-69-0
CAS Name: ammonium 2-[(5E)-4-oxo-5-(phenylmethylene)-2-sulfanylidene-3-thiazolidinyl]acetate
OPENEYE Name: ammonium 2-[(5E)-5-benzylidene-4-oxo-2-thioxo-thiazolidin-3-yl]acetate
IUPAC Name: azanium 2-[(5E)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetate
SYSTEMATIC NAME: azanium 2-[(5E)-4-oxidanylidene-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoate
MOLECULAR FORMULA: C12H12N2O3S2
MOLECULAR WEIGHT: 296.36528
SMILES: C1=CC=C(C=C1)/C=C/2\C(=O)N(C(=S)S2)CC(=O)[O-].[NH4+]
Structure:
CAS RN: 96593-16-7
CAS Name: sodium 2-[4-(4-chlorophenyl)-2-phenyl-5-thiazolyl]acetate
OPENEYE Name: sodium 2-[4-(4-chlorophenyl)-2-phenyl-thiazol-5-yl]acetate
IUPAC Name: sodium 2-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]acetate
SYSTEMATIC NAME: sodium 2-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]ethanoate
MOLECULAR FORMULA: C17H11ClNNaO2S
MOLECULAR WEIGHT: 351.78251
SMILES: C1=CC=C(C=C1)C2=NC(=C(S2)CC(=O)[O-])C3=CC=C(C=C3)Cl.[Na+]
Structure:
CAS RN: 102628-31-9
CAS Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-2-thiazolyl]-[(2-methoxyphenyl)methyl]sulfamic acid
OPENEYE Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxo-ethyl)thiazol-2-yl]-[(2-methoxyphenyl)methyl]sulfamic acid
IUPAC Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-methoxyphenyl)methyl]sulfamic acid
SYSTEMATIC NAME: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-[(2-methoxyphenyl)methyl]sulfamic acid
MOLECULAR FORMULA: C20H19ClN2O6S2
MOLECULAR WEIGHT: 482.95766
SMILES: COC1=CC=CC=C1CN(C2=NC(=C(S2)CC(=O)OC)C3=CC=C(C=C3)Cl)S(=O)(=O)O
Structure:
CAS RN: 102612-88-4
CAS Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-2-thiazolyl]-[(2-hydroxyphenyl)methyl]sulfamic acid
OPENEYE Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxo-ethyl)thiazol-2-yl]-[(2-hydroxyphenyl)methyl]sulfamic acid
IUPAC Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-hydroxyphenyl)methyl]sulfamic acid
SYSTEMATIC NAME: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-[(2-hydroxyphenyl)methyl]sulfamic acid
MOLECULAR FORMULA: C19H17ClN2O6S2
MOLECULAR WEIGHT: 468.93108
SMILES: COC(=O)CC1=C(N=C(S1)N(CC2=CC=CC=C2O)S(=O)(=O)O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 102367-78-2
CAS Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-2-thiazolyl]-[[2-(dimethylamino)phenyl]methyl]sulfamic acid
OPENEYE Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxo-ethyl)thiazol-2-yl]-[[2-(dimethylamino)phenyl]methyl]sulfamic acid
IUPAC Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[[2-(dimethylamino)phenyl]methyl]sulfamic acid
SYSTEMATIC NAME: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-[[2-(dimethylamino)phenyl]methyl]sulfamic acid
MOLECULAR FORMULA: C21H22ClN3O5S2
MOLECULAR WEIGHT: 495.99948
SMILES: CN(C)C1=CC=CC=C1CN(C2=NC(=C(S2)CC(=O)OC)C3=CC=C(C=C3)Cl)S(=O)(=O)O
Structure:
CAS RN: 102367-77-1
CAS Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-2-thiazolyl]-[(2-chlorophenyl)methyl]sulfamic acid
OPENEYE Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxo-ethyl)thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid
IUPAC Name: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxoethyl)-1,3-thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid
SYSTEMATIC NAME: [4-(4-chlorophenyl)-5-(2-methoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-[(2-chlorophenyl)methyl]sulfamic acid
MOLECULAR FORMULA: C19H16Cl2N2O5S2
MOLECULAR WEIGHT: 487.37674
SMILES: COC(=O)CC1=C(N=C(S1)N(CC2=CC=CC=C2Cl)S(=O)(=O)O)C3=CC=C(C=C3)Cl
Structure:
CAS RN: 104746-33-0
CAS Name: 3-[4-(2,4-dioxo-1,3-thiazinan-3-yl)butyl]-1,3-thiazinane-2,4-dione
OPENEYE Name: 3-[4-(2,4-dioxo-1,3-thiazinan-3-yl)butyl]-1,3-thiazinane-2,4-dione
IUPAC Name: 3-[4-(2,4-dioxo-1,3-thiazinan-3-yl)butyl]-1,3-thiazinane-2,4-dione
SYSTEMATIC NAME: 3-[4-[2,4-bis(oxidanylidene)-1,3-thiazinan-3-yl]butyl]-1,3-thiazinane-2,4-dione
MOLECULAR FORMULA: C12H16N2O4S2
MOLECULAR WEIGHT: 316.39644
SMILES: C1CSC(=O)N(C1=O)CCCCN2C(=O)CCSC2=O
Structure:
CAS RN: 96434-10-5
CAS Name: 2,6-dimethylpyridine; 6-ethyl-1,1-dioxo-1,2,4-thiadiazinane-3,5-dione
OPENEYE Name: 2,6-dimethylpyridine; 6-ethyl-1,1-dioxo-1,2,4-thiadiazinane-3,5-dione
IUPAC Name: 2,6-dimethylpyridine; 6-ethyl-1,1-dioxo-1,2,4-thiadiazinane-3,5-dione
SYSTEMATIC NAME: 2,6-dimethylpyridine; 6-ethyl-1,1-bis(oxidanylidene)-1,2,4-thiadiazinane-3,5-dione
MOLECULAR FORMULA: C12H17N3O4S
MOLECULAR WEIGHT: 299.34608
SMILES: CCC1C(=O)NC(=O)NS1(=O)=O.CC1=NC(=CC=C1)C
Structure:
CAS RN: 102367-62-4
CAS Name: 2-(4-chlorophenyl)-2,5-diphenyl-1,3,2-thiazasilolidine
OPENEYE Name: 2-(4-chlorophenyl)-2,5-diphenyl-1,3,2-thiazasilolidine
IUPAC Name: 2-(4-chlorophenyl)-2,5-diphenyl-1,3,2-thiazasilolidine
SYSTEMATIC NAME: 2-(4-chlorophenyl)-2,5-diphenyl-1,3,2-thiazasilolidine
MOLECULAR FORMULA: C20H18ClNSSi
MOLECULAR WEIGHT: 367.96712
SMILES: C1C(S[Si](N1)(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4
Structure:
CAS RN: 97518-16-6
CAS Name: disodium (6R,7R)-7-[[(E)-2-(2-amino-4-thiazolyl)-4-carboxylato-1-oxobut-2-enyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
OPENEYE Name: disodium (6R,7R)-7-[[(E)-2-(2-aminothiazol-4-yl)-4-carboxylato-but-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC Name: disodium (6R,7R)-7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxylatobut-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: disodium (6R,7R)-7-[[(E)-2-(2-azanyl-1,3-thiazol-4-yl)-5-oxidanidyl-5-oxidanylidene-pent-2-enoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C15H12N4Na2O6S2
MOLECULAR WEIGHT: 454.38852
SMILES: C1C=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=C/CC(=O)[O-])/C3=CSC(=N3)N)C(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 97547-76-7
CAS Name: disodium (6R,7R)-7-[[(E)-2-(2-amino-4-thiazolyl)-4-carboxylato-1-oxobut-2-enyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
OPENEYE Name: disodium (6R,7R)-7-[[(E)-2-(2-aminothiazol-4-yl)-4-carboxylato-but-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
IUPAC Name: disodium (6R,7R)-7-[[(E)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxylatobut-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SYSTEMATIC NAME: disodium (6R,7R)-7-[[(E)-2-(2-azanyl-1,3-thiazol-4-yl)-5-oxidanidyl-5-oxidanylidene-pent-2-enoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
MOLECULAR FORMULA: C15H12N4Na2O6S2
MOLECULAR WEIGHT: 454.38852
SMILES: C1C=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=C/CC(=O)[O-])/C3=CSC(=N3)N)C(=O)[O-].[Na+].[Na+]
Structure:
CAS RN: 102367-60-2
CAS Name: 3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenoxybutyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid; 1-phenyl-N-(phenylmethyl)methanamine
OPENEYE Name: N-benzyl-1-phenyl-methanamine; 3,3-dimethyl-7-oxo-6-(2-phenoxybutanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC Name: N-benzyl-1-phenylmethanamine; 3,3-dimethyl-7-oxo-6-(2-phenoxybutanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: 3,3-dimethyl-7-oxidanylidene-6-(2-phenoxybutanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid; 1-phenyl-N-(phenylmethyl)methanamine
MOLECULAR FORMULA: C32H37N3O5S
MOLECULAR WEIGHT: 575.71828
SMILES: CCC(C(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)O)OC3=CC=CC=C3.C1=CC=C(C=C1)CNCC2=CC=CC=C2
Structure:
CAS RN: 96593-30-5
CAS Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-1-oxo-2-[[oxo-[2-oxo-6-[(E)-prop-1-enyl]-1H-pyridin-3-yl]methyl]amino]ethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
OPENEYE Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxo-6-[(E)-prop-1-enyl]-1H-pyridine-3-carbonyl]amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxo-6-[(E)-prop-1-enyl]-1H-pyridine-3-carbonyl]amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxidanylidene-6-[(E)-prop-1-enyl]-1H-pyridin-3-yl]carbonylamino]ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C25H25N4NaO7S
MOLECULAR WEIGHT: 548.54337
SMILES: C/C=C/C1=CC=C(C(=O)N1)C(=O)NC(C2=CC=C(C=C2)O)C(=O)N[C@@H]3[C@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+]
Structure:
CAS RN: 96593-29-2
CAS Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-1-oxo-2-[[oxo-[2-oxo-6-[(E)-2-phenylethenyl]-1H-pyridin-3-yl]methyl]amino]ethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
OPENEYE Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxo-6-[(E)-styryl]-1H-pyridine-3-carbonyl]amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxo-6-[(E)-2-phenylethenyl]-1H-pyridine-3-carbonyl]amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[2-oxidanylidene-6-[(E)-2-phenylethenyl]-1H-pyridin-3-yl]carbonylamino]ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C30H27N4NaO7S
MOLECULAR WEIGHT: 610.61275
SMILES: CC1([C@@H](N2[C@@H](S1)[C@H](C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)C4=CC=C(NC4=O)/C=C/C5=CC=CC=C5)C(=O)[O-])C.[Na+]
Structure:
CAS RN: 96593-45-2
CAS Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[[(6-methyl-4-oxo-1H-pyridin-3-yl)-oxomethyl]amino]-1-oxoethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
OPENEYE Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[(6-methyl-4-oxo-1H-pyridine-3-carbonyl)amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
IUPAC Name: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[(6-methyl-4-oxo-1H-pyridine-3-carbonyl)amino]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SYSTEMATIC NAME: sodium (2S,5S,6S)-6-[[2-(4-hydroxyphenyl)-2-[(6-methyl-4-oxidanylidene-1H-pyridin-3-yl)carbonylamino]ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
MOLECULAR FORMULA: C23H23N4NaO7S
MOLECULAR WEIGHT: 522.50609
SMILES: CC1=CC(=O)C(=CN1)C(=O)NC(C2=CC=C(C=C2)O)C(=O)N[C@@H]3[C@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+]
Structure:
CAS RN: 96434-27-4
CAS Name: 1,3-dimethyl-8-(4-piperidinyl)-7H-purine-2,6-dione hydrochloride
OPENEYE Name: 1,3-dimethyl-8-(4-piperidyl)-7H-purine-2,6-dione hydrochloride
IUPAC Name: 1,3-dimethyl-8-piperidin-4-yl-7H-purine-2,6-dione hydrochloride
SYSTEMATIC NAME: 1,3-dimethyl-8-piperidin-4-yl-7H-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C12H18ClN5O2
MOLECULAR WEIGHT: 299.75662
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCNCC3.Cl
Structure:
CAS RN: 96434-26-3
CAS Name: 1,3-dimethyl-8-(3-piperidinyl)-7H-purine-2,6-dione hydrochloride
OPENEYE Name: 1,3-dimethyl-8-(3-piperidyl)-7H-purine-2,6-dione hydrochloride
IUPAC Name: 1,3-dimethyl-8-piperidin-3-yl-7H-purine-2,6-dione hydrochloride
SYSTEMATIC NAME: 1,3-dimethyl-8-piperidin-3-yl-7H-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C12H18ClN5O2
MOLECULAR WEIGHT: 299.75662
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCNC3.Cl
Structure:
CAS RN: 96434-25-2
CAS Name: 1,3-dimethyl-8-(2-piperidinyl)-7H-purine-2,6-dione hydrochloride
OPENEYE Name: 1,3-dimethyl-8-(2-piperidyl)-7H-purine-2,6-dione hydrochloride
IUPAC Name: 1,3-dimethyl-8-piperidin-2-yl-7H-purine-2,6-dione hydrochloride
SYSTEMATIC NAME: 1,3-dimethyl-8-piperidin-2-yl-7H-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C12H18ClN5O2
MOLECULAR WEIGHT: 299.75662
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCCN3.Cl
Structure:
CAS RN: 92985-74-5
CAS Name: 7-ethyl-1,3-dimethyl-6-sulfanylidene-2-purinone
OPENEYE Name: 7-ethyl-1,3-dimethyl-6-thioxo-purin-2-one
IUPAC Name: 7-ethyl-1,3-dimethyl-6-sulfanylidenepurin-2-one
SYSTEMATIC NAME: 7-ethyl-1,3-dimethyl-6-sulfanylidene-purin-2-one
MOLECULAR FORMULA: C9H12N4OS
MOLECULAR WEIGHT: 224.28278
SMILES: CCN1C=NC2=C1C(=S)N(C(=O)N2C)C
Structure:
CAS RN: 97361-19-8
CAS Name: 8-(1-ethyl-4-piperidinyl)-1,3-dimethyl-7H-purine-2,6-dione hydrochloride
OPENEYE Name: 8-(1-ethyl-4-piperidyl)-1,3-dimethyl-7H-purine-2,6-dione hydrochloride
IUPAC Name: 8-(1-ethylpiperidin-4-yl)-1,3-dimethyl-7H-purine-2,6-dione hydrochloride
SYSTEMATIC NAME: 8-(1-ethylpiperidin-4-yl)-1,3-dimethyl-7H-purine-2,6-dione hydrochloride
MOLECULAR FORMULA: C14H22ClN5O2
MOLECULAR WEIGHT: 327.80978
SMILES: CCN1CCC(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C.Cl
Structure:
CAS RN: 97194-78-0
CAS Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidene-2-purinone; iodomethane
OPENEYE Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-thioxo-purin-2-one; iodomethane
IUPAC Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidenepurin-2-one; iodomethane
SYSTEMATIC NAME: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidene-purin-2-one; iodanylmethane
MOLECULAR FORMULA: C14H24IN5OS
MOLECULAR WEIGHT: 437.34273
SMILES: CCN(CC)CCN1C=NC2=C1C(=S)N(C(=O)N2C)C.CI
Structure:
CAS RN: 96313-22-3
CAS Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidene-2-purinone hydrochloride
OPENEYE Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-thioxo-purin-2-one hydrochloride
IUPAC Name: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidenepurin-2-one hydrochloride
SYSTEMATIC NAME: 7-[2-(diethylamino)ethyl]-1,3-dimethyl-6-sulfanylidene-purin-2-one hydrochloride
MOLECULAR FORMULA: C13H22ClN5OS
MOLECULAR WEIGHT: 331.86468
SMILES: CCN(CC)CCN1C=NC2=C1C(=S)N(C(=O)N2C)C.Cl
Structure:
CAS RN: 96357-62-9
CAS Name: (4S,8R)-4,8-bis(1-aziridinyl)-N2,N2,N2',N2',N4,N4,N6,N6,N6',N6',N8,N8-dodecamethyl-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraene-2,2,4,6,6,8-hexamine
OPENEYE Name: (4S,8R)-4,8-bis(aziridin-1-yl)-N2,N2,N2',N2',N4,N4,N6,N6,N6',N6',N8,N8-dodecamethyl-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraene-2,2,4,6,6,8-hexamine
IUPAC Name: (4S,8R)-4,8-bis(aziridin-1-yl)-2-N,2-N,2-N',2-N',4-N,4-N,6-N,6-N,6-N',6-N',8-N,8-N-dodecamethyl-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraene-2,2,4,6,6,8-hexamine
SYSTEMATIC NAME: (4S,8R)-4,8-bis(aziridin-1-yl)-N2,N2,N2',N2',N4,N4,N6,N6,N6',N6',N8,N8-dodecamethyl-1,3,5,7-tetraza-2$l^{5},4$l^{5},6$l^{5},8$l^{5}-tetraphosphacycloocta-1,3,5,7-tetraene-2,2,4,6,6,8-hexamine
MOLECULAR FORMULA: C16H44N12P4
MOLECULAR WEIGHT: 528.496004
SMILES: CN(C)[P@@]1(=NP(=N[P@@](=NP(=N1)(N(C)C)N(C)C)(N2CC2)N(C)C)(N(C)C)N(C)C)N3CC3
Structure:
CAS RN: 95548-12-2
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-tetradecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]tetradec-9-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]tetradec-9-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]tetradec-9-enamide
MOLECULAR FORMULA: C22H35NO3
MOLECULAR WEIGHT: 361.5182
SMILES: CCCC/C=C\CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 102457-85-2
CAS Name: 4-[[5-(4-aminophenoxy)pentylamino]-oxomethyl]benzoic acid methyl ester
OPENEYE Name: methyl 4-[5-(4-aminophenoxy)pentylcarbamoyl]benzoate
IUPAC Name: methyl 4-[5-(4-aminophenoxy)pentylcarbamoyl]benzoate
SYSTEMATIC NAME: methyl 4-[5-(4-azanylphenoxy)pentylcarbamoyl]benzoate
MOLECULAR FORMULA: C20H24N2O4
MOLECULAR WEIGHT: 356.41556
SMILES: COC(=O)C1=CC=C(C=C1)C(=O)NCCCCCOC2=CC=C(C=C2)N
Structure:
CAS RN: 8011-76-5
CAS Name: calcium phosphoric acid
OPENEYE Name: calcium phosphoric acid
IUPAC Name: calcium phosphoric acid
SYSTEMATIC NAME: calcium phosphoric acid
MOLECULAR FORMULA: CaH6O8P2+2
MOLECULAR WEIGHT: 236.068362
SMILES: OP(=O)(O)O.OP(=O)(O)O.[Ca+2]
Structure:
CAS RN: 102432-82-6
CAS Name: (7-dimethylsulfonio-10H-phenothiazin-3-yl)-dimethylsulfonium; hydrogen sulfite
OPENEYE Name: (7-dimethylsulfonio-10H-phenothiazin-3-yl)-dimethyl-sulfonium; hydrogen sulfite
IUPAC Name: (7-dimethylsulfonio-10H-phenothiazin-3-yl)-dimethylsulfanium; hydrogen sulfite
SYSTEMATIC NAME: (7-dimethylsulfonio-10H-phenothiazin-3-yl)-dimethyl-sulfanium; hydrogen sulfite
MOLECULAR FORMULA: C16H21NO6S5
MOLECULAR WEIGHT: 483.66604
SMILES: C[S+](C)C1=CC2=C(C=C1)NC3=C(S2)C=C(C=C3)[S+](C)C.OS(=O)[O-].OS(=O)[O-]
Structure:
CAS RN: 80518-95-2
CAS Name: dimethyl-[2-(2-oxolanyl)ethyl]sulfonium; 4-methylbenzenesulfonate
OPENEYE Name: dimethyl(2-tetrahydrofuran-2-ylethyl)sulfonium; 4-methylbenzenesulfonate
IUPAC Name: dimethyl-[2-(oxolan-2-yl)ethyl]sulfanium; 4-methylbenzenesulfonate
SYSTEMATIC NAME: dimethyl-[2-(oxolan-2-yl)ethyl]sulfanium; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C15H24O4S2
MOLECULAR WEIGHT: 332.47866
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].C[S+](C)CCC1CCCO1
Structure:
CAS RN: 102395-93-7
CAS Name: sodium (4-aminophenyl)sulfonyl-thiophen-2-ylazanide
OPENEYE Name: sodium (4-aminophenyl)sulfonyl-(2-thienyl)azanide
IUPAC Name: sodium (4-aminophenyl)sulfonyl-thiophen-2-ylazanide
SYSTEMATIC NAME: sodium (4-aminophenyl)sulfonyl-thiophen-2-yl-azanide
MOLECULAR FORMULA: C10H9N2NaO2S2
MOLECULAR WEIGHT: 276.31043
SMILES: C1=CSC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)N.[Na+]
Structure:
CAS RN: 102395-89-1
CAS Name: sodium (4-aminophenyl)sulfonyl-(2-methoxy-4-quinazolinyl)azanide
OPENEYE Name: sodium (4-aminophenyl)sulfonyl-(2-methoxyquinazolin-4-yl)azanide
IUPAC Name: sodium (4-aminophenyl)sulfonyl-(2-methoxyquinazolin-4-yl)azanide
SYSTEMATIC NAME: sodium (4-aminophenyl)sulfonyl-(2-methoxyquinazolin-4-yl)azanide
MOLECULAR FORMULA: C15H13N4NaO3S
MOLECULAR WEIGHT: 352.34349
SMILES: COC1=NC2=CC=CC=C2C(=N1)[N-]S(=O)(=O)C3=CC=C(C=C3)N.[Na+]
Structure:
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