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

Systemtic Name: 4-[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)butanamide Openeye Name: 4-[2-(4-acetamidoanilino)-2-oxo-ethyl]sulfanyl-N-(m-tolyl)butanamide CAS Name: 4-[[2-(4-acetamidoanilino)-2-oxoethyl]thio]-N-(3-methylphenyl)butanamide IUPAC Name: 4-[2-(4-acetamidoanilino)-2-oxoethyl]sulfanyl-N-(3-methylphenyl)butanamide Traditional Name: 4-[[2-(4-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=C(C=C2)NC(=O)C

Isomeric SMILES

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

InChI

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