4-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)butanamide

Systemtic Name: 4-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)butanamide Openeye Name: 4-[2-(3-acetamidoanilino)-2-oxo-ethyl]sulfanyl-N-(m-tolyl)butanamide CAS Name: 4-[[2-(3-acetamidoanilino)-2-oxoethyl]thio]-N-(3-methylphenyl)butanamide IUPAC Name: 4-[2-(3-acetamidoanilino)-2-oxoethyl]sulfanyl-N-(3-methylphenyl)butanamide Traditional Name: 4-[[2-(3-acetamidoanilino)-2-keto-ethyl]thio]-N-(m-tolyl)butyramide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CCCSCC(=O)NC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C21H25N3O3S/c1-15-6-3-7-17(12-15)23-20(26)10-5-11-28-14-21(27)24-19-9-4-8-18(13-19)22-16(2)25/h3-4,6-9,12-13H,5,10-11,14H2,1-2H3,(H,22,25)(H,23,26)(H,24,27)