methyl 2-[(3-azanyl-5-phenyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(3-azanyl-5-phenyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(3-amino-5-phenyl-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(3-amino-5-phenylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(3-amino-5-phenylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(3-amino-5-phenyl-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CC(=CC(=C1)C2=CC=CC=C2)N

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)C1=CC(=CC(=C1)C2=CC=CC=C2)N

InChI

InChI=1S/C19H22N2O3S/c1-24-19(23)17(8-9-25-2)21-18(22)15-10-14(11-16(20)12-15)13-6-4-3-5-7-13/h3-7,10-12,17H,8-9,20H2,1-2H3,(H,21,22)