CAS RN: 173174-90-8
CAS Name: 5,6-dimethyl-2-(4-morpholinylmethyl)pyrrolo[3,4-c]pyridine-1,3,4-trione
OPENEYE Name: 5,6-dimethyl-2-(morpholinomethyl)pyrrolo[3,4-c]pyridine-1,3,4-trione
IUPAC Name: 5,6-dimethyl-2-(morpholin-4-ylmethyl)pyrrolo[3,4-c]pyridine-1,3,4-trione
SYSTEMATIC NAME: 5,6-dimethyl-2-(morpholin-4-ylmethyl)pyrrolo[3,4-c]pyridine-1,3,4-trione
MOLECULAR FORMULA: C14H17N3O4
MOLECULAR WEIGHT: 291.30248
SMILES: CC1=CC2=C(C(=O)N1C)C(=O)N(C2=O)CN3CCOCC3
Structure:
CAS RN: 173174-88-4
CAS Name: 2-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propyl]-6-methyl-4-(1-piperidinyl)pyrrolo[3,4-c]pyridine-1,3-dione
OPENEYE Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-6-methyl-4-(1-piperidyl)pyrrolo[3,4-c]pyridine-1,3-dione
IUPAC Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-6-methyl-4-piperidin-1-ylpyrrolo[3,4-c]pyridine-1,3-dione
SYSTEMATIC NAME: 6-methyl-2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propyl]-4-piperidin-1-yl-pyrrolo[3,4-c]pyridine-1,3-dione
MOLECULAR FORMULA: C26H33N5O3
MOLECULAR WEIGHT: 463.57192
SMILES: CC1=NC(=C2C(=C1)C(=O)N(C2=O)CC(CN3CCN(CC3)C4=CC=CC=C4)O)N5CCCCC5
Structure:
CAS RN: 173174-86-2
CAS Name: 2-[3-[4-(2-hydroxyethyl)-1-piperazinyl]propyl]-6-methyl-4-(1-piperidinyl)pyrrolo[3,4-c]pyridine-1,3-dione dihydrochloride
OPENEYE Name: 2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-6-methyl-4-(1-piperidyl)pyrrolo[3,4-c]pyridine-1,3-dione dihydrochloride
IUPAC Name: 2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-6-methyl-4-piperidin-1-ylpyrrolo[3,4-c]pyridine-1,3-dione dihydrochloride
SYSTEMATIC NAME: 2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-6-methyl-4-piperidin-1-yl-pyrrolo[3,4-c]pyridine-1,3-dione dihydrochloride
MOLECULAR FORMULA: C22H35Cl2N5O3
MOLECULAR WEIGHT: 488.451
SMILES: CC1=NC(=C2C(=C1)C(=O)N(C2=O)CCCN3CCN(CC3)CCO)N4CCCCC4.Cl.Cl
Structure:
CAS RN: 173174-85-1
CAS Name: 2-[[bis(2-hydroxyethyl)amino]methyl]-6-methyl-4-(1-piperidinyl)pyrrolo[3,4-c]pyridine-1,3-dione
OPENEYE Name: 2-[[bis(2-hydroxyethyl)amino]methyl]-6-methyl-4-(1-piperidyl)pyrrolo[3,4-c]pyridine-1,3-dione
IUPAC Name: 2-[[bis(2-hydroxyethyl)amino]methyl]-6-methyl-4-piperidin-1-ylpyrrolo[3,4-c]pyridine-1,3-dione
SYSTEMATIC NAME: 2-[[bis(2-hydroxyethyl)amino]methyl]-6-methyl-4-piperidin-1-yl-pyrrolo[3,4-c]pyridine-1,3-dione
MOLECULAR FORMULA: C18H26N4O4
MOLECULAR WEIGHT: 362.42344
SMILES: CC1=NC(=C2C(=C1)C(=O)N(C2=O)CN(CCO)CCO)N3CCCCC3
Structure:
CAS RN: 173174-79-3
CAS Name: 6-methyl-4-(4-methyl-1-piperazinyl)-2-(1-pyrrolidinylmethyl)pyrrolo[3,4-c]pyridine-1,3-dione
OPENEYE Name: 6-methyl-4-(4-methylpiperazin-1-yl)-2-(pyrrolidin-1-ylmethyl)pyrrolo[3,4-c]pyridine-1,3-dione
IUPAC Name: 6-methyl-4-(4-methylpiperazin-1-yl)-2-(pyrrolidin-1-ylmethyl)pyrrolo[3,4-c]pyridine-1,3-dione
SYSTEMATIC NAME: 6-methyl-4-(4-methylpiperazin-1-yl)-2-(pyrrolidin-1-ylmethyl)pyrrolo[3,4-c]pyridine-1,3-dione
MOLECULAR FORMULA: C18H25N5O2
MOLECULAR WEIGHT: 343.4234
SMILES: CC1=NC(=C2C(=C1)C(=O)N(C2=O)CN3CCCC3)N4CCN(CC4)C
Structure:
CAS RN: 173095-38-0
CAS Name: 4-(4-methylphenyl)-2,4-dioxo-N-(1,2,4-triazol-4-yl)butanamide
OPENEYE Name: 2,4-dioxo-4-(p-tolyl)-N-(1,2,4-triazol-4-yl)butanamide
IUPAC Name: 4-(4-methylphenyl)-2,4-dioxo-N-(1,2,4-triazol-4-yl)butanamide
SYSTEMATIC NAME: 4-(4-methylphenyl)-2,4-bis(oxidanylidene)-N-(1,2,4-triazol-4-yl)butanamide
MOLECULAR FORMULA: C13H12N4O3
MOLECULAR WEIGHT: 272.25938
SMILES: CC1=CC=C(C=C1)C(=O)CC(=O)C(=O)NN2C=NN=C2
Structure:
CAS RN: 173087-59-7
CAS Name: N-[4-(7-acetyl-8-methyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]-2-aminoacetamide hydrochloride
OPENEYE Name: N-[4-(7-acetyl-8-methyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]-2-amino-acetamide hydrochloride
IUPAC Name: N-[4-(7-acetyl-8-methyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]-2-aminoacetamide hydrochloride
SYSTEMATIC NAME: 2-azanyl-N-[4-(7-ethanoyl-8-methyl-8,9-dihydro-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl)phenyl]ethanamide hydrochloride
MOLECULAR FORMULA: C21H23ClN4O4
MOLECULAR WEIGHT: 430.88472
SMILES: CC1CC2=CC3=C(C=C2C(=NN1C(=O)C)C4=CC=C(C=C4)NC(=O)CN)OCO3.Cl
Structure:
CAS RN: 172985-41-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H20BrCl3N2O4
MOLECULAR WEIGHT: 622.7217
SMILES: CC1(CC2=C3C(=C(OC3=NC(=C2CO1)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br)NC(=O)C(Cl)(Cl)Cl)C
Structure:
CAS RN: 172985-38-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H18BrCl3N2O4
MOLECULAR WEIGHT: 560.65232
SMILES: CC1=C2COC(CC2=C3C(=C(OC3=N1)C(=O)C4=CC=C(C=C4)Br)NC(=O)C(Cl)(Cl)Cl)(C)C
Structure:
CAS RN: 172985-36-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H21BrN2O4
MOLECULAR WEIGHT: 457.31714
SMILES: CC1=C2COC(CC2=C3C(=C(OC3=N1)C(=O)C4=CC=C(C=C4)Br)NC(=O)C)(C)C
Structure:
CAS RN: 172985-35-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H23ClN2O3
MOLECULAR WEIGHT: 446.92542
SMILES: CC1(CC2=C3C(=C(OC3=NC(=C2CO1)CC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl)N)C
Structure:
CAS RN: 172985-33-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H24N2O3
MOLECULAR WEIGHT: 412.48036
SMILES: CC1(CC2=C3C(=C(OC3=NC(=C2CO1)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5)N)C
Structure:
CAS RN: 172985-30-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C25H22N2O3
MOLECULAR WEIGHT: 398.45378
SMILES: CC1(CC2=C3C(=C(OC3=NC(=C2CO1)C4=CC=CC=C4)C(=O)C5=CC=CC=C5)N)C
Structure:
CAS RN: 172985-27-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H20N2O4
MOLECULAR WEIGHT: 388.4159
SMILES: CC1(CC2=C3C(=C(OC3=NC(=C2CO1)C4=CC=CO4)C(=O)C5=CC=CC=C5)N)C
Structure:
CAS RN: 172985-19-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H21BrN2O3
MOLECULAR WEIGHT: 429.30704
SMILES: CCC1=C2COC(CC2=C3C(=C(OC3=N1)C(=O)C4=CC=C(C=C4)Br)N)(C)C
Structure:
CAS RN: 172985-17-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H19ClN2O3
MOLECULAR WEIGHT: 370.82946
SMILES: CC1=C2COC(CC2=C3C(=C(OC3=N1)C(=O)C4=CC=C(C=C4)Cl)N)(C)C
Structure:
CAS RN: 172984-93-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C12H18N6O2
MOLECULAR WEIGHT: 278.31032
SMILES: C1C(=O)NN=C2C13CN4CC2(CN(C3)C4)CC(=O)NN
Structure:
CAS RN: 172984-91-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H24N2O5
MOLECULAR WEIGHT: 324.37216
SMILES: CCC(=O)OCC12CN3CC(C1=O)(CN(C2)C3)CC(=O)OCC
Structure:
CAS RN: 172982-80-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C15H10N2O6
MOLECULAR WEIGHT: 314.2497
SMILES: C1C2=C(C(C3=C(N2)COC3=O)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)O1
Structure:
CAS RN: 172982-79-5
CAS Name: 4-[2-(difluoromethylsulfonyl)phenyl]-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 4-[2-(difluoromethylsulfonyl)phenyl]-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate
IUPAC Name: ethyl 4-[2-(difluoromethylsulfonyl)phenyl]-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate
SYSTEMATIC NAME: ethyl 4-[2-[bis(fluoranyl)methylsulfonyl]phenyl]-2-methyl-5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate
MOLECULAR FORMULA: C18H17F2NO6S
MOLECULAR WEIGHT: 413.392486
SMILES: CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3S(=O)(=O)C(F)F)C(=O)OC2)C
Structure:
CAS RN: 172882-04-1
CAS Name: 1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one dihydrochloride
OPENEYE Name: 1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one dihydrochloride
IUPAC Name: 1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one dihydrochloride
SYSTEMATIC NAME: 1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one dihydrochloride
MOLECULAR FORMULA: C9H18Cl2N2O
MOLECULAR WEIGHT: 241.15802
SMILES: CC12CNCC(C1=O)(CNC2)C.Cl.Cl
Structure:
CAS RN: 172882-03-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H17ClN2O
MOLECULAR WEIGHT: 216.70778
SMILES: CC12CN3CC(C1=O)(CN(C2)C3)C.Cl
Structure:
CAS RN: 172882-02-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H22Cl2N3O2P
MOLECULAR WEIGHT: 354.212441
SMILES: CC12CN3CC(C1=O)(CN(C2)P3(=O)N(CCCl)CCCl)C
Structure:
CAS RN: 172882-01-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C26H32Cl2N3O4P
MOLECULAR WEIGHT: 552.429741
SMILES: CC12CN3CC(C1=O)(CN(C2)C3C4=CC=C(C=C4)OP(=O)(N(CCCl)CCCl)OC5=CC=CC=C5)C
Structure:
CAS RN: 172882-00-7
CAS Name: 7-(2-chloroethyl)-3-[(2-chloroethylamino)-phenoxyphosphoryl]-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
OPENEYE Name: 7-(2-chloroethyl)-3-[(2-chloroethylamino)-phenoxy-phosphoryl]-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
IUPAC Name: 7-(2-chloroethyl)-3-[(2-chloroethylamino)-phenoxyphosphoryl]-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 7-(2-chloroethyl)-3-[(2-chloroethylamino)-phenoxy-phosphoryl]-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C19H28Cl2N3O3P
MOLECULAR WEIGHT: 448.323681
SMILES: CC12CN(CC(C1=O)(CN(C2)P(=O)(NCCCl)OC3=CC=CC=C3)C)CCCl
Structure:
CAS RN: 172881-97-9
CAS Name: 3-diphenoxyphosphoryl-1,5-dimethyl-9-oxo-N-propyl-3,7-diazabicyclo[3.3.1]nonane-7-carbothioamide
OPENEYE Name: 3-diphenoxyphosphoryl-1,5-dimethyl-9-oxo-N-propyl-3,7-diazabicyclo[3.3.1]nonane-7-carbothioamide
IUPAC Name: 3-diphenoxyphosphoryl-1,5-dimethyl-9-oxo-N-propyl-3,7-diazabicyclo[3.3.1]nonane-7-carbothioamide
SYSTEMATIC NAME: 3-diphenoxyphosphoryl-1,5-dimethyl-9-oxidanylidene-N-propyl-3,7-diazabicyclo[3.3.1]nonane-7-carbothioamide
MOLECULAR FORMULA: C25H32N3O4PS
MOLECULAR WEIGHT: 501.578041
SMILES: CCCNC(=S)N1CC2(CN(CC(C1)(C2=O)C)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)C
Structure:
CAS RN: 172881-96-8
CAS Name: 3-diphenoxyphosphoryl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
OPENEYE Name: 3-diphenoxyphosphoryl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
IUPAC Name: 3-diphenoxyphosphoryl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
SYSTEMATIC NAME: 3-diphenoxyphosphoryl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
MOLECULAR FORMULA: C21H25N2O4P
MOLECULAR WEIGHT: 400.407961
SMILES: CC12CNCC(C1=O)(CN(C2)P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)C
Structure:
CAS RN: 172800-05-4
CAS Name: N-(2-octoxyphenyl)carbamic acid [(1R,2R)-2-[(dimethylamino)methyl]cyclohexyl] ester hydrochloride
OPENEYE Name: [(1R,2R)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2R)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2R)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C24H41ClN2O3
MOLECULAR WEIGHT: 441.04694
SMILES: CCCCCCCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCC[C@@H]2CN(C)C.Cl
Structure:
CAS RN: 172800-04-3
CAS Name: N-(2-octoxyphenyl)carbamic acid [(1R,2S)-2-[(dimethylamino)methyl]cyclohexyl] ester hydrochloride
OPENEYE Name: [(1R,2S)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2S)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2S)-2-[(dimethylamino)methyl]cyclohexyl] N-(2-octoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C24H41ClN2O3
MOLECULAR WEIGHT: 441.04694
SMILES: CCCCCCCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCC[C@H]2CN(C)C.Cl
Structure:
CAS RN: 172800-03-2
CAS Name: N-(2-butoxyphenyl)carbamic acid [(1R,2R)-2-(1-piperidinylmethyl)cycloheptyl] ester hydrochloride
OPENEYE Name: [(1R,2R)-2-(1-piperidylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2R)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2R)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C24H39ClN2O3
MOLECULAR WEIGHT: 439.03106
SMILES: CCCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCCC[C@@H]2CN3CCCCC3.Cl
Structure:
CAS RN: 172800-02-1
CAS Name: N-(2-butoxyphenyl)carbamic acid [(1R,2S)-2-(1-piperidinylmethyl)cycloheptyl] ester hydrochloride
OPENEYE Name: [(1R,2S)-2-(1-piperidylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2S)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2S)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-butoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C24H39ClN2O3
MOLECULAR WEIGHT: 439.03106
SMILES: CCCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCCC[C@H]2CN3CCCCC3.Cl
Structure:
CAS RN: 172800-01-0
CAS Name: N-(2-propoxyphenyl)carbamic acid [(1R,2R)-2-(1-piperidinylmethyl)cycloheptyl] ester hydrochloride
OPENEYE Name: [(1R,2R)-2-(1-piperidylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2R)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2R)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C23H37ClN2O3
MOLECULAR WEIGHT: 425.00448
SMILES: CCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCCC[C@@H]2CN3CCCCC3.Cl
Structure:
CAS RN: 172800-00-9
CAS Name: N-(2-propoxyphenyl)carbamic acid [(1R,2S)-2-(1-piperidinylmethyl)cycloheptyl] ester hydrochloride
OPENEYE Name: [(1R,2S)-2-(1-piperidylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
IUPAC Name: [(1R,2S)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(1R,2S)-2-(piperidin-1-ylmethyl)cycloheptyl] N-(2-propoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C23H37ClN2O3
MOLECULAR WEIGHT: 425.00448
SMILES: CCCOC1=CC=CC=C1NC(=O)O[C@@H]2CCCCC[C@H]2CN3CCCCC3.Cl
Structure:
CAS RN: 172798-64-0
CAS Name: (2S)-2-[[(2S)-2-[[(4-butoxyphenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-4-(methylthio)butanoic acid
OPENEYE Name: (2S)-2-[[(2S)-2-[(4-butoxybenzoyl)amino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid
IUPAC Name: (2S)-2-[[(2S)-2-[(4-butoxybenzoyl)amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoic acid
SYSTEMATIC NAME: (2S)-2-[[(2S)-2-[(4-butoxyphenyl)carbonylamino]-3-phenyl-propanoyl]amino]-4-methylsulfanyl-butanoic acid
MOLECULAR FORMULA: C25H32N2O5S
MOLECULAR WEIGHT: 472.59698
SMILES: CCCCOC1=CC=C(C=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCSC)C(=O)O
Structure:
CAS RN: 172798-63-9
CAS Name: 4-[[2-[[(4-butoxyphenyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]butanoic acid
OPENEYE Name: 4-[[2-[(4-butoxybenzoyl)amino]-3-phenyl-propanoyl]amino]butanoic acid
IUPAC Name: 4-[[2-[(4-butoxybenzoyl)amino]-3-phenylpropanoyl]amino]butanoic acid
SYSTEMATIC NAME: 4-[[2-[(4-butoxyphenyl)carbonylamino]-3-phenyl-propanoyl]amino]butanoic acid
MOLECULAR FORMULA: C24H30N2O5
MOLECULAR WEIGHT: 426.5054
SMILES: CCCCOC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCC(=O)O
Structure:
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