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

Systemtic Name: 4-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)butanamide Openeye Name: 4-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanyl-N-(m-tolyl)butanamide CAS Name: 4-[[2-(3-cyanoanilino)-2-oxoethyl]thio]-N-(3-methylphenyl)butanamide IUPAC Name: 4-[2-(3-cyanoanilino)-2-oxoethyl]sulfanyl-N-(3-methylphenyl)butanamide Traditional Name: 4-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]-N-(m-tolyl)butyramide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-15-5-2-7-17(11-15)22-19(24)9-4-10-26-14-20(25)23-18-8-3-6-16(12-18)13-21/h2-3,5-8,11-12H,4,9-10,14H2,1H3,(H,22,24)(H,23,25)