2-azanyl-2-[2-[4-[ethanoyl-(1-methylimidazol-4-yl)amino]phenyl]phenyl]carbonyl-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-azanyl-2-[2-[4-[ethanoyl-(1-methylimidazol-4-yl)amino]phenyl]phenyl]carbonyl-4-methylsulfanyl-butanoic acid Openeye Name: 2-[2-[4-[acetyl-(1-methylimidazol-4-yl)amino]phenyl]benzoyl]-2-amino-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[4-[acetyl-(1-methyl-4-imidazolyl)amino]phenyl]phenyl]-oxomethyl]-2-amino-4-(methylthio)butanoic acid IUPAC Name: 2-[2-[4-[acetyl-(1-methylimidazol-4-yl)amino]phenyl]benzoyl]-2-amino-4-methylsulfanylbutanoic acid Traditional Name: 2-[2-[4-[acetyl-(1-methylimidazol-4-yl)amino]phenyl]benzoyl]-2-amino-4-(methylthio)butyric acid Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2C(=O)C(CCSC)(C(=O)O)N)C3=CN(C=N3)C

Isomeric SMILES

CC(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2C(=O)C(CCSC)(C(=O)O)N)C3=CN(C=N3)C

InChI

InChI=1S/C24H26N4O4S/c1-16(29)28(21-14-27(2)15-26-21)18-10-8-17(9-11-18)19-6-4-5-7-20(19)22(30)24(25,23(31)32)12-13-33-3/h4-11,14-15H,12-13,25H2,1-3H3,(H,31,32)