S-(3-oxidanylidene-3-phenyl-propanoyl) 4-azanylidene-4-(3-oxidanylidene-3-phenyl-propanoyl)sulfanyl-butanethioate

Systemtic Name: S-(3-oxidanylidene-3-phenyl-propanoyl) 4-azanylidene-4-(3-oxidanylidene-3-phenyl-propanoyl)sulfanyl-butanethioate Openeye Name: S-(3-oxo-3-phenyl-propanoyl) 4-imino-4-(3-oxo-3-phenyl-propanoyl)sulfanyl-butanethioate CAS Name: 4-[(1,3-dioxo-3-phenylpropyl)thio]-4-iminobutanethioic acid S-(1,3-dioxo-3-phenylpropyl) ester IUPAC Name: S-(3-oxo-3-phenylpropanoyl) 4-imino-4-(3-oxo-3-phenylpropanoyl)sulfanylbutanethioate Traditional Name: 4-imino-4-[(3-keto-3-phenyl-propanoyl)thio]butanethioic acid S-(3-keto-3-phenyl-propanoyl) ester Formula: C22H19NO5S2 MolecularWeight: 441.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(=O)SC(=N)CCC(=O)SC(=O)CC(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(=O)SC(=N)CCC(=O)SC(=O)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H19NO5S2/c23-19(29-21(27)13-17(24)15-7-3-1-4-8-15)11-12-20(26)30-22(28)14-18(25)16-9-5-2-6-10-16/h1-10,23H,11-14H2