CAS RN: 124393-85-7
CAS Name: cyclohexyl-[(4,4-dimethyl-1-piperazin-4-iumyl)methyl]-hydroxy-phenylsilane
OPENEYE Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-hydroxy-phenyl-silane
IUPAC Name: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-hydroxy-phenylsilane
SYSTEMATIC NAME: cyclohexyl-[(4,4-dimethylpiperazin-4-ium-1-yl)methyl]-oxidanyl-phenyl-silane
MOLECULAR FORMULA: C19H33N2OSi+
MOLECULAR WEIGHT: 333.56362
SMILES: C[N+]1(CCN(CC1)C[Si](C2CCCCC2)(C3=CC=CC=C3)O)C
Structure:
CAS RN: 173026-17-0
CAS Name: 4,4-dimethyl-2,3-dihydro-1,2-benzoselenazine
OPENEYE Name: 4,4-dimethyl-2,3-dihydro-1,2-benzoselenazine
IUPAC Name: 4,4-dimethyl-2,3-dihydro-1,2-benzoselenazine
SYSTEMATIC NAME: 4,4-dimethyl-2,3-dihydro-1,2-benzoselenazine
MOLECULAR FORMULA: C10H13NSe
MOLECULAR WEIGHT: 226.17692
SMILES: CC1(CN[Se]C2=CC=CC=C21)C
Structure:
CAS RN: 108549-46-8
CAS Name: 4-[3-(2,4-dihydroxyphenyl)-3-hydroxypropyl]benzene-1,2-diol
OPENEYE Name: 4-[3-(2,4-dihydroxyphenyl)-3-hydroxy-propyl]benzene-1,2-diol
IUPAC Name: 4-[3-(2,4-dihydroxyphenyl)-3-hydroxypropyl]benzene-1,2-diol
SYSTEMATIC NAME: 4-[3-[2,4-bis(oxidanyl)phenyl]-3-oxidanyl-propyl]benzene-1,2-diol
MOLECULAR FORMULA: C15H16O5
MOLECULAR WEIGHT: 276.28454
SMILES: C1=CC(=C(C=C1CCC(C2=C(C=C(C=C2)O)O)O)O)O
Structure:
CAS RN: 108549-45-7
CAS Name: 4-[2-hydroxy-3-(3-hydroxyphenyl)propyl]benzene-1,3-diol
OPENEYE Name: 4-[2-hydroxy-3-(3-hydroxyphenyl)propyl]benzene-1,3-diol
IUPAC Name: 4-[2-hydroxy-3-(3-hydroxyphenyl)propyl]benzene-1,3-diol
SYSTEMATIC NAME: 4-[3-(3-hydroxyphenyl)-2-oxidanyl-propyl]benzene-1,3-diol
MOLECULAR FORMULA: C15H16O4
MOLECULAR WEIGHT: 260.28514
SMILES: C1=CC(=CC(=C1)O)CC(CC2=C(C=C(C=C2)O)O)O
Structure:
CAS RN: 124345-19-3
CAS Name: 4-[di(propan-2-yloxy)methyl]heptane
OPENEYE Name: 4-(diisopropoxymethyl)heptane
IUPAC Name: 4-[di(propan-2-yloxy)methyl]heptane
SYSTEMATIC NAME: 4-[di(propan-2-yloxy)methyl]heptane
MOLECULAR FORMULA: C14H30O2
MOLECULAR WEIGHT: 230.3868
SMILES: CCCC(CCC)C(OC(C)C)OC(C)C
Structure:
CAS RN: 124345-17-1
CAS Name: 4-(diethoxymethyl)heptane
OPENEYE Name: 4-(diethoxymethyl)heptane
IUPAC Name: 4-(diethoxymethyl)heptane
SYSTEMATIC NAME: 4-(diethoxymethyl)heptane
MOLECULAR FORMULA: C12H26O2
MOLECULAR WEIGHT: 202.33364
SMILES: CCCC(CCC)C(OCC)OCC
Structure:
CAS RN: 124345-16-0
CAS Name: 4-(dimethoxymethyl)heptane
OPENEYE Name: 4-(dimethoxymethyl)heptane
IUPAC Name: 4-(dimethoxymethyl)heptane
SYSTEMATIC NAME: 4-(dimethoxymethyl)heptane
MOLECULAR FORMULA: C10H22O2
MOLECULAR WEIGHT: 174.28048
SMILES: CCCC(CCC)C(OC)OC
Structure:
CAS RN: 124325-93-5
CAS Name: (2R,7R,8S)-8-bromo-4-hydroxy-7-methyl-1-oxo-6-[oxo-(5,6,7-trimethoxy-1H-indol-2-yl)methyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylic acid methyl ester
OPENEYE Name: methyl (2R,7R,8S)-8-bromo-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
IUPAC Name: methyl (2R,7R,8S)-8-bromo-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
SYSTEMATIC NAME: methyl (2R,7R,8S)-8-bromanyl-7-methyl-4-oxidanyl-1-oxidanylidene-6-[(5,6,7-trimethoxy-1H-indol-2-yl)carbonyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
MOLECULAR FORMULA: C26H26BrN3O8
MOLECULAR WEIGHT: 588.40394
SMILES: C[C@@H]1[C@H](CC2=C3C(=O)[C@@H](NC3=C(C=C2N1C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC)O)C(=O)OC)Br
Structure:
CAS RN: 124323-49-5
CAS Name: N-(2-amino-2-oxoethyl)-2-fluoro-6-methoxy-5-(trifluoromethyl)-1-naphthalenecarboxamide
OPENEYE Name: N-(2-amino-2-oxo-ethyl)-2-fluoro-6-methoxy-5-(trifluoromethyl)naphthalene-1-carboxamide
IUPAC Name: N-(2-amino-2-oxoethyl)-2-fluoro-6-methoxy-5-(trifluoromethyl)naphthalene-1-carboxamide
SYSTEMATIC NAME: N-(2-azanyl-2-oxidanylidene-ethyl)-2-fluoranyl-6-methoxy-5-(trifluoromethyl)naphthalene-1-carboxamide
MOLECULAR FORMULA: C15H12F4N2O3
MOLECULAR WEIGHT: 344.260993
SMILES: COC1=C(C2=C(C=C1)C(=C(C=C2)F)C(=O)NCC(=O)N)C(F)(F)F
Structure:
CAS RN: 108536-61-4
CAS Name: N-(6-benzamido-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide
OPENEYE Name: N-(6-benzamido-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide
IUPAC Name: N-(6-benzamido-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide
SYSTEMATIC NAME: N-(6-benzamido-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzamide
MOLECULAR FORMULA: C19H14N6O2
MOLECULAR WEIGHT: 358.35346
SMILES: C1=CC=C(C=C1)C(=O)NC2=NC(=NC3=C2C=NN3)NC(=O)C4=CC=CC=C4
Structure:
CAS RN: 124294-43-5
CAS Name: 4-methyl-3-[4-[(phenylmethyl)amino]-7-quinazolinyl]-4,5-dihydro-1H-pyridazin-6-one
OPENEYE Name: 3-[4-(benzylamino)quinazolin-7-yl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one
IUPAC Name: 3-[4-(benzylamino)quinazolin-7-yl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one
SYSTEMATIC NAME: 4-methyl-3-[4-[(phenylmethyl)amino]quinazolin-7-yl]-4,5-dihydro-1H-pyridazin-6-one
MOLECULAR FORMULA: C20H19N5O
MOLECULAR WEIGHT: 345.39776
SMILES: CC1CC(=O)NN=C1C2=CC3=C(C=C2)C(=NC=N3)NCC4=CC=CC=C4
Structure:
CAS RN: 108535-01-9
CAS Name: 3-(2-aminoethyl)-4-[3-(2-aminoethyl)-5-hydroxy-1H-indol-4-yl]-1H-indol-5-ol
OPENEYE Name: 3-(2-aminoethyl)-4-[3-(2-aminoethyl)-5-hydroxy-1H-indol-4-yl]-1H-indol-5-ol
IUPAC Name: 3-(2-aminoethyl)-4-[3-(2-aminoethyl)-5-hydroxy-1H-indol-4-yl]-1H-indol-5-ol
SYSTEMATIC NAME: 3-(2-azanylethyl)-4-[3-(2-azanylethyl)-5-oxidanyl-1H-indol-4-yl]-1H-indol-5-ol
MOLECULAR FORMULA: C20H22N4O2
MOLECULAR WEIGHT: 350.41428
SMILES: C1=CC(=C(C2=C1NC=C2CCN)C3=C(C=CC4=C3C(=CN4)CCN)O)O
Structure:
CAS RN: 124277-35-6
CAS Name: 2-oxo-N-(2-pyridinylmethyl)-1,3-dihydropyrrole-5-carboxamide
OPENEYE Name: 2-oxo-N-(2-pyridylmethyl)-1,3-dihydropyrrole-5-carboxamide
IUPAC Name: 2-oxo-N-(pyridin-2-ylmethyl)-1,3-dihydropyrrole-5-carboxamide
SYSTEMATIC NAME: 2-oxidanylidene-N-(pyridin-2-ylmethyl)-1,3-dihydropyrrole-5-carboxamide
MOLECULAR FORMULA: C11H11N3O2
MOLECULAR WEIGHT: 217.22394
SMILES: C1C=C(NC1=O)C(=O)NCC2=CC=CC=N2
Structure:
CAS RN: 124277-34-5
CAS Name: 1-[(4-chlorophenyl)methyl]-5-oxo-2-pyrrolidinecarboxylate
OPENEYE Name: 1-[(4-chlorophenyl)methyl]-5-oxo-pyrrolidine-2-carboxylate
IUPAC Name: 1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-2-carboxylate
SYSTEMATIC NAME: 1-[(4-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylate
MOLECULAR FORMULA: C12H11ClNO3-
MOLECULAR WEIGHT: 252.67364
SMILES: C1CC(=O)N(C1C(=O)[O-])CC2=CC=C(C=C2)Cl
Structure:
CAS RN: 108499-48-5
CAS Name: 2-[(5,6-dimethoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-N-ethylaniline
OPENEYE Name: 2-[(5,6-dimethoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-N-ethyl-aniline
IUPAC Name: 2-[(5,6-dimethoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-N-ethylaniline
SYSTEMATIC NAME: 2-[(5,6-dimethoxy-1H-benzimidazol-2-yl)sulfinylmethyl]-N-ethyl-aniline
MOLECULAR FORMULA: C18H21N3O3S
MOLECULAR WEIGHT: 359.44264
SMILES: CCNC1=CC=CC=C1CS(=O)C2=NC3=CC(=C(C=C3N2)OC)OC
Structure:
CAS RN: 124262-82-4
CAS Name: 2-[2,2-bis[4-(dimethylamino)phenyl]ethyl]benzenesulfonic acid
OPENEYE Name: 2-[2,2-bis[4-(dimethylamino)phenyl]ethyl]benzenesulfonic acid
IUPAC Name: 2-[2,2-bis[4-(dimethylamino)phenyl]ethyl]benzenesulfonic acid
SYSTEMATIC NAME: 2-[2,2-bis[4-(dimethylamino)phenyl]ethyl]benzenesulfonic acid
MOLECULAR FORMULA: C24H28N2O3S
MOLECULAR WEIGHT: 424.55572
SMILES: CN(C)C1=CC=C(C=C1)C(CC2=CC=CC=C2S(=O)(=O)O)C3=CC=C(C=C3)N(C)C
Structure:
CAS RN: 108498-50-6
CAS Name: 2-(2-furanylmethylsulfinyl)-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]acetamide
OPENEYE Name: 2-(2-furylmethylsulfinyl)-N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]acetamide
IUPAC Name: 2-(furan-2-ylmethylsulfinyl)-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]acetamide
SYSTEMATIC NAME: 2-(furan-2-ylmethylsulfinyl)-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]ethanamide
MOLECULAR FORMULA: C22H30N2O4S
MOLECULAR WEIGHT: 418.5496
SMILES: C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC(=O)CS(=O)CC3=CC=CO3
Structure:
CAS RN: 124256-00-4
CAS Name: (2S)-2-[[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxo-3-phenylpropyl]amino]-1,5-dioxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-N-[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropa
OPENEYE Name: (2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxo-pentanoyl]pyrrolidine-2-carbonyl]amino]-N-[(1S)-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]
IUPAC Name: (2S)-2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-N-[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5
SYSTEMATIC NAME: (2S)-2-[[(2S)-1-[(2S)-5-azanyl-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoyl]amino]-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-3
MOLECULAR FORMULA: C54H76N14O11
MOLECULAR WEIGHT: 1097.26844
SMILES: CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(=O)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
Structure:
CAS RN: 108495-27-8
CAS Name: N-[2-[[3-[4-[2-[2-(cyclopropylmethoxy)ethoxy]ethyl]phenoxy]-2-hydroxypropyl]amino]ethyl]-4-hydroxy-1-piperidinecarboxamide
OPENEYE Name: N-[2-[[3-[4-[2-[2-(cyclopropylmethoxy)ethoxy]ethyl]phenoxy]-2-hydroxy-propyl]amino]ethyl]-4-hydroxy-piperidine-1-carboxamide
IUPAC Name: N-[2-[[3-[4-[2-[2-(cyclopropylmethoxy)ethoxy]ethyl]phenoxy]-2-hydroxypropyl]amino]ethyl]-4-hydroxypiperidine-1-carboxamide
SYSTEMATIC NAME: N-[2-[[3-[4-[2-[2-(cyclopropylmethoxy)ethoxy]ethyl]phenoxy]-2-oxidanyl-propyl]amino]ethyl]-4-oxidanyl-piperidine-1-carboxamide
MOLECULAR FORMULA: C25H41N3O6
MOLECULAR WEIGHT: 479.60954
SMILES: C1CC1COCCOCCC2=CC=C(C=C2)OCC(CNCCNC(=O)N3CCC(CC3)O)O
Structure:
CAS RN: 124251-89-4
CAS Name: (8S,9S,10R,11S,13S,14S,17R)-6,11-dihydroxy-17-(2-hydroxyethyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carboxaldehyde
OPENEYE Name: (8S,9S,10R,11S,13S,14S,17R)-6,11-dihydroxy-17-(2-hydroxyethyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde
IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-6,11-dihydroxy-17-(2-hydroxyethyl)-10-methyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde
SYSTEMATIC NAME: (8S,9S,10R,11S,13S,14S,17R)-17-(2-hydroxyethyl)-10-methyl-6,11-bis(oxidanyl)-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-13-carbaldehyde
MOLECULAR FORMULA: C21H30O5
MOLECULAR WEIGHT: 362.4599
SMILES: C[C@]12CCC(=O)C=C1C(C[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4CCO)C=O)O)O
Structure:
CAS RN: 108461-05-8
CAS Name: 1-cyclopropyl-6-fluoro-7-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-4-oxo-3-quinolinecarboxylic acid
OPENEYE Name: 1-cyclopropyl-6-fluoro-7-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-4-oxo-quinoline-3-carboxylic acid
IUPAC Name: 1-cyclopropyl-6-fluoro-7-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-4-oxoquinoline-3-carboxylic acid
SYSTEMATIC NAME: 1-cyclopropyl-6-fluoranyl-7-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)-4-oxidanylidene-quinoline-3-carboxylic acid
MOLECULAR FORMULA: C20H22FN3O3
MOLECULAR WEIGHT: 371.405383
SMILES: CN1C2CCC1CN(C2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F
Structure:
CAS RN: 124216-70-2
CAS Name: [1-[(2S)-2-[[[(2R)-2-acetamido-1-oxo-3-phenylpropyl]amino]-oxomethyl]-1-pyrrolidinyl]-4-(diaminomethylideneamino)butyl]boronic acid
OPENEYE Name: [1-[(2S)-2-[[(2R)-2-acetamido-3-phenyl-propanoyl]carbamoyl]pyrrolidin-1-yl]-4-guanidino-butyl]boronic acid
IUPAC Name: [1-[(2S)-2-[[(2R)-2-acetamido-3-phenylpropanoyl]carbamoyl]pyrrolidin-1-yl]-4-(diaminomethylideneamino)butyl]boronic acid
SYSTEMATIC NAME: [1-[(2S)-2-[[(2R)-2-acetamido-3-phenyl-propanoyl]carbamoyl]pyrrolidin-1-yl]-4-[bis(azanyl)methylideneamino]butyl]boronic acid
MOLECULAR FORMULA: C21H33BN6O5
MOLECULAR WEIGHT: 460.33492
SMILES: B(C(CCCN=C(N)N)N1CCC[C@H]1C(=O)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C)(O)O
Structure:
CAS RN: 108428-42-8
CAS Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
OPENEYE Name: 2-(2-amino-1-hydroxy-cyclobutyl)acetic acid
IUPAC Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
SYSTEMATIC NAME: 2-(2-azanyl-1-oxidanyl-cyclobutyl)ethanoic acid
MOLECULAR FORMULA: C6H11NO3
MOLECULAR WEIGHT: 145.15644
SMILES: C1CC(C1N)(CC(=O)O)O
Structure:
CAS RN: 108507-92-2
CAS Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
OPENEYE Name: 2-(2-amino-1-hydroxy-cyclobutyl)acetic acid
IUPAC Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
SYSTEMATIC NAME: 2-(2-azanyl-1-oxidanyl-cyclobutyl)ethanoic acid
MOLECULAR FORMULA: C6H11NO3
MOLECULAR WEIGHT: 145.15644
SMILES: C1CC(C1N)(CC(=O)O)O
Structure:
CAS RN: 148219-08-3
CAS Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
OPENEYE Name: 2-(2-amino-1-hydroxy-cyclobutyl)acetic acid
IUPAC Name: 2-(2-amino-1-hydroxycyclobutyl)acetic acid
SYSTEMATIC NAME: 2-(2-azanyl-1-oxidanyl-cyclobutyl)ethanoic acid
MOLECULAR FORMULA: C6H11NO3
MOLECULAR WEIGHT: 145.15644
SMILES: C1CC(C1N)(CC(=O)O)O
Structure:
CAS RN: 124206-66-2
CAS Name: 1-(3-methoxyphenyl)-N-methyl-2-propanamine
OPENEYE Name: 1-(3-methoxyphenyl)-N-methyl-propan-2-amine
IUPAC Name: 1-(3-methoxyphenyl)-N-methylpropan-2-amine
SYSTEMATIC NAME: 1-(3-methoxyphenyl)-N-methyl-propan-2-amine
MOLECULAR FORMULA: C11H17NO
MOLECULAR WEIGHT: 179.25878
SMILES: CC(CC1=CC(=CC=C1)OC)NC
Structure:
CAS RN: 108427-72-1
CAS Name: 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)-4-pyrido[1,2-a]pyrimidinone
OPENEYE Name: 9-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-3-(2H-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
IUPAC Name: 9-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-3-(2H-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
SYSTEMATIC NAME: 9-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-3-(2H-1,2,3,4-tetrazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
MOLECULAR FORMULA: C21H20N6O4
MOLECULAR WEIGHT: 420.4213
SMILES: CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CN3C2=NC=C(C3=O)C4=NNN=N4
Structure:
CAS RN: 124199-70-8
CAS Name: 2-benzamido-3-phenylpropanoic acid 1-naphthalenyl ester
OPENEYE Name: 1-naphthyl 2-benzamido-3-phenyl-propanoate
IUPAC Name: naphthalen-1-yl 2-benzamido-3-phenylpropanoate
SYSTEMATIC NAME: naphthalen-1-yl 2-benzamido-3-phenyl-propanoate
MOLECULAR FORMULA: C26H21NO3
MOLECULAR WEIGHT: 395.44984
SMILES: C1=CC=C(C=C1)CC(C(=O)OC2=CC=CC3=CC=CC=C32)NC(=O)C4=CC=CC=C4
Structure:
CAS RN: 124199-66-2
CAS Name: [3-(1-oxohexadecoxy)-2-[1-oxo-8-[1-[4-[3-(trifluoromethyl)-1-diazirinyl]phenyl]ethoxy]octoxy]propyl] 2-(trimethylammonio)ethyl phosphate
OPENEYE Name: [3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylammonio)ethyl phosphate
IUPAC Name: [3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
SYSTEMATIC NAME: [3-hexadecanoyloxy-2-[8-[1-[4-[3-(trifluoromethyl)-1,2-diazirin-1-yl]phenyl]ethoxy]octanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
MOLECULAR FORMULA: C42H71F3N3O9P
MOLECULAR WEIGHT: 849.996811
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCOC(C)C1=CC=C(C=C1)N2C(=N2)C(F)(F)F
Structure:
CAS RN: 108418-13-9
CAS Name: (2S)-2-amino-3-(5-mercapto-3-methyl-4-imidazolyl)propanoic acid
OPENEYE Name: (2S)-2-amino-3-(3-methyl-5-sulfanyl-imidazol-4-yl)propanoic acid
IUPAC Name: (2S)-2-amino-3-(3-methyl-5-sulfanylimidazol-4-yl)propanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-3-(3-methyl-5-sulfanyl-imidazol-4-yl)propanoic acid
MOLECULAR FORMULA: C7H11N3O2S
MOLECULAR WEIGHT: 201.24614
SMILES: CN1C=NC(=C1C[C@@H](C(=O)O)N)S
Structure:
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