N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-4-(phenylmethylsulfanyl)butanamide Openeye Name: 4-benzylsulfanyl-N-(3-cyano-4,5-dimethyl-2-thienyl)butanamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-4-(phenylmethylthio)butanamide IUPAC Name: 4-benzylsulfanyl-N-(3-cyano-4,5-dimethylthiophen-2-yl)butanamide Traditional Name: 4-(benzylthio)-N-(3-cyano-4,5-dimethyl-2-thienyl)butyramide Formula: C18H20N2OS2 MolecularWeight: 344.4942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CCCSCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CCCSCC2=CC=CC=C2)C

InChI

InChI=1S/C18H20N2OS2/c1-13-14(2)23-18(16(13)11-19)20-17(21)9-6-10-22-12-15-7-4-3-5-8-15/h3-5,7-8H,6,9-10,12H2,1-2H3,(H,20,21)