CAS RN: 4874-01-5
CAS Name: 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylthio]acetic acid
OPENEYE Name: 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylsulfanyl]acetic acid
IUPAC Name: 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methylsulfanyl]acetic acid
SYSTEMATIC NAME: 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methylsulfanyl]ethanoic acid
MOLECULAR FORMULA: C7H8N2O4S
MOLECULAR WEIGHT: 216.21442
SMILES: C1=C(C(=O)NC(=O)N1)CSCC(=O)O
Structure:
CAS RN: 4897-44-3
CAS Name: 5-[(phenylmethylthio)methyl]-1H-pyrimidine-2,4-dione
OPENEYE Name: 5-(benzylsulfanylmethyl)-1H-pyrimidine-2,4-dione
IUPAC Name: 5-(benzylsulfanylmethyl)-1H-pyrimidine-2,4-dione
SYSTEMATIC NAME: 5-[(phenylmethylsulfanyl)methyl]-1H-pyrimidine-2,4-dione
MOLECULAR FORMULA: C12H12N2O2S
MOLECULAR WEIGHT: 248.30088
SMILES: C1=CC=C(C=C1)CSCC2=CNC(=O)NC2=O
Structure:
CAS RN: 92345-03-4
CAS Name: 2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphospholidine-4-carboxylic acid
OPENEYE Name: 2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphospholidine-4-carboxylic acid
IUPAC Name: 2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphospholidine-4-carboxylic acid
SYSTEMATIC NAME: 2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3,2$l^{5}-oxazaphospholidine-4-carboxylic acid
MOLECULAR FORMULA: C7H13Cl2N2O4P
MOLECULAR WEIGHT: 291.068881
SMILES: C1C(NP(=O)(O1)N(CCCl)CCCl)C(=O)O
Structure:
CAS RN: 28314-05-8
CAS Name: 1-chloro-9H-fluorene
OPENEYE Name: 1-chloro-9H-fluorene
IUPAC Name: 1-chloro-9H-fluorene
SYSTEMATIC NAME: 1-chloranyl-9H-fluorene
MOLECULAR FORMULA: C13H9Cl
MOLECULAR WEIGHT: 200.66356
SMILES: C1C2=CC=CC=C2C3=C1C(=CC=C3)Cl
Structure:
CAS RN: 4338-38-9
CAS Name: 1-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]pyrimidine-2,4-dione
OPENEYE Name: 1-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyrimidine-2,4-dione
IUPAC Name: 1-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[4-azanyl-6-(hydroxymethyl)-3,5-bis(oxidanyl)oxan-2-yl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C10H15N3O6
MOLECULAR WEIGHT: 273.2426
SMILES: C1=CN(C(=O)NC1=O)C2C(C(C(C(O2)CO)O)N)O
Structure:
CAS RN: 16979-62-7
CAS Name: 2-amino-3-(7-methoxy-1H-indol-3-yl)propanoic acid
OPENEYE Name: 2-amino-3-(7-methoxy-1H-indol-3-yl)propanoic acid
IUPAC Name: 2-amino-3-(7-methoxy-1H-indol-3-yl)propanoic acid
SYSTEMATIC NAME: 2-azanyl-3-(7-methoxy-1H-indol-3-yl)propanoic acid
MOLECULAR FORMULA: C12H14N2O3
MOLECULAR WEIGHT: 234.25116
SMILES: COC1=CC=CC2=C1NC=C2CC(C(=O)O)N
Structure:
CAS RN: 4298-10-6
CAS Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-fluoro-2-pyrimidinone
OPENEYE Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-fluoro-pyrimidin-2-one
IUPAC Name: 4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidin-2-one
SYSTEMATIC NAME: 4-azanyl-5-fluoranyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]pyrimidin-2-one
MOLECULAR FORMULA: C9H12FN3O5
MOLECULAR WEIGHT: 261.207083
SMILES: C1=C(C(=NC(=O)N1C2C(C(C(O2)CO)O)O)N)F
Structure:
CAS RN: 3905-00-8
CAS Name: N1,N3,4-trimethyl-N1,N3-bis-(4-methylphenyl)sulfonylbenzene-1,3-disulfonamide
OPENEYE Name: N1,N3,4-trimethyl-N1,N3-bis(p-tolylsulfonyl)benzene-1,3-disulfonamide
IUPAC Name: 1-N,3-N,4-trimethyl-1-N,3-N-bis-(4-methylphenyl)sulfonylbenzene-1,3-disulfonamide
SYSTEMATIC NAME: N1,N3,4-trimethyl-N1,N3-bis-(4-methylphenyl)sulfonyl-benzene-1,3-disulfonamide
MOLECULAR FORMULA: C23H26N2O8S4
MOLECULAR WEIGHT: 586.72114
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)S(=O)(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N(C)S(=O)(=O)C3=CC=C(C=C3)C
Structure:
CAS RN: 50994-51-9
CAS Name: N-(4-hydroxyphenyl)-4-nitrobenzenesulfonamide
OPENEYE Name: N-(4-hydroxyphenyl)-4-nitro-benzenesulfonamide
IUPAC Name: N-(4-hydroxyphenyl)-4-nitrobenzenesulfonamide
SYSTEMATIC NAME: N-(4-hydroxyphenyl)-4-nitro-benzenesulfonamide
MOLECULAR FORMULA: C12H10N2O5S
MOLECULAR WEIGHT: 294.2832
SMILES: C1=CC(=CC=C1NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])O
Structure:
CAS RN: 51425-88-8
CAS Name: 4-methylbenzenesulfonic acid 3-[(4-methylphenyl)sulfonylamino]propyl ester
OPENEYE Name: 3-(p-tolylsulfonylamino)propyl 4-methylbenzenesulfonate
IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]propyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: 3-[(4-methylphenyl)sulfonylamino]propyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C17H21NO5S2
MOLECULAR WEIGHT: 383.48234
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NCCCOS(=O)(=O)C2=CC=C(C=C2)C
Structure:
CAS RN: 16602-89-4
CAS Name: 1,2-bis(1-phenylpropan-2-yl)hydrazine
OPENEYE Name: 1,2-bis(1-methyl-2-phenyl-ethyl)hydrazine
IUPAC Name: 1,2-bis(1-phenylpropan-2-yl)hydrazine
SYSTEMATIC NAME: 1,2-bis(1-phenylpropan-2-yl)diazane
MOLECULAR FORMULA: C18H24N2
MOLECULAR WEIGHT: 268.39656
SMILES: CC(CC1=CC=CC=C1)NNC(C)CC2=CC=CC=C2
Structure:
CAS RN: 7585-89-9
CAS Name: 4-methylbenzoic acid [5-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-[(4-methylphenyl)-oxomethoxy]-2-oxolanyl]methyl ester
OPENEYE Name: [5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-(4-methylbenzoyl)oxy-tetrahydrofuran-2-yl]methyl 4-methylbenzoate
IUPAC Name: [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-(4-methylbenzoyl)oxyoxolan-2-yl]methyl 4-methylbenzoate
SYSTEMATIC NAME: [5-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-(4-methylphenyl)carbonyloxy-oxolan-2-yl]methyl 4-methylbenzoate
MOLECULAR FORMULA: C25H23FN2O7
MOLECULAR WEIGHT: 482.457723
SMILES: CC1=CC=C(C=C1)C(=O)OCC2C(CC(O2)N3C=C(C(=O)NC3=O)F)OC(=O)C4=CC=C(C=C4)C
Structure:
CAS RN: 1596-36-7
CAS Name: N-(4,5-dichloro-2-nitrophenyl)benzenesulfonamide
OPENEYE Name: N-(4,5-dichloro-2-nitro-phenyl)benzenesulfonamide
IUPAC Name: N-(4,5-dichloro-2-nitrophenyl)benzenesulfonamide
SYSTEMATIC NAME: N-[4,5-bis(chloranyl)-2-nitro-phenyl]benzenesulfonamide
MOLECULAR FORMULA: C12H8Cl2N2O4S
MOLECULAR WEIGHT: 347.17392
SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2[N+](=O)[O-])Cl)Cl
Structure:
CAS RN: 1157-41-1
CAS Name: 3-[(5-nitro-2-furanyl)methylideneamino]-4-quinazolinone
OPENEYE Name: 3-[(5-nitro-2-furyl)methyleneamino]quinazolin-4-one
IUPAC Name: 3-[(5-nitrofuran-2-yl)methylideneamino]quinazolin-4-one
SYSTEMATIC NAME: 3-[(5-nitrofuran-2-yl)methylideneamino]quinazolin-4-one
MOLECULAR FORMULA: C13H8N4O4
MOLECULAR WEIGHT: 284.22702
SMILES: C1=CC=C2C(=C1)C(=O)N(C=N2)N=CC3=CC=C(O3)[N+](=O)[O-]
Structure:
CAS RN: 5584-25-8
CAS Name: 3-amino-N-[(5-nitro-2-furanyl)methylideneamino]benzamide
OPENEYE Name: 3-amino-N-[(5-nitro-2-furyl)methyleneamino]benzamide
IUPAC Name: 3-amino-N-[(5-nitrofuran-2-yl)methylideneamino]benzamide
SYSTEMATIC NAME: 3-azanyl-N-[(5-nitrofuran-2-yl)methylideneamino]benzamide
MOLECULAR FORMULA: C12H10N4O4
MOLECULAR WEIGHT: 274.2322
SMILES: C1=CC(=CC(=C1)N)C(=O)NN=CC2=CC=C(O2)[N+](=O)[O-]
Structure:
CAS RN: 82633-33-8
CAS Name: 5-bromo-1-methyl-2-oxoindole-3,3,4-tricarboxylic acid trimethyl ester
OPENEYE Name: trimethyl 5-bromo-1-methyl-2-oxo-indoline-3,3,4-tricarboxylate
IUPAC Name: trimethyl 5-bromo-1-methyl-2-oxoindole-3,3,4-tricarboxylate
SYSTEMATIC NAME: trimethyl 5-bromanyl-1-methyl-2-oxidanylidene-indole-3,3,4-tricarboxylate
MOLECULAR FORMULA: C15H14BrNO7
MOLECULAR WEIGHT: 400.17816
SMILES: CN1C2=C(C(=C(C=C2)Br)C(=O)OC)C(C1=O)(C(=O)OC)C(=O)OC
Structure:
CAS RN: 70164-13-5
CAS Name: 2-(butylthio)-1,3,2-dithiaphospholane
OPENEYE Name: 2-butylsulfanyl-1,3,2-dithiaphospholane
IUPAC Name: 2-butylsulfanyl-1,3,2-dithiaphospholane
SYSTEMATIC NAME: 2-butylsulfanyl-1,3,2-dithiaphospholane
MOLECULAR FORMULA: C6H13PS3
MOLECULAR WEIGHT: 212.336181
SMILES: CCCCSP1SCCS1
Structure:
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