methyl 4-azanyl-5-oxidanylidene-5-phenylazanyl-2-phenylsulfanyl-pentanoate

Systemtic Name: methyl 4-azanyl-5-oxidanylidene-5-phenylazanyl-2-phenylsulfanyl-pentanoate Openeye Name: methyl 4-amino-5-anilino-5-oxo-2-phenylsulfanyl-pentanoate CAS Name: 4-amino-5-anilino-5-oxo-2-(phenylthio)pentanoic acid methyl ester IUPAC Name: methyl 4-amino-5-anilino-5-oxo-2-phenylsulfanylpentanoate Traditional Name: 4-amino-5-anilino-5-keto-2-(phenylthio)valeric acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(C(=O)NC1=CC=CC=C1)N)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC(C(=O)NC1=CC=CC=C1)N)SC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O3S/c1-23-18(22)16(24-14-10-6-3-7-11-14)12-15(19)17(21)20-13-8-4-2-5-9-13/h2-11,15-16H,12,19H2,1H3,(H,20,21)