N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: 2-benzylsulfonyl-N-(3-cyano-4,5-dimethyl-2-thienyl)acetamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-(phenylmethyl)sulfonylacetamide IUPAC Name: 2-benzylsulfonyl-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide Traditional Name: 2-benzylsulfonyl-N-(3-cyano-4,5-dimethyl-2-thienyl)acetamide Formula: C16H16N2O3S2 MolecularWeight: 348.43984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CS(=O)(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CS(=O)(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H16N2O3S2/c1-11-12(2)22-16(14(11)8-17)18-15(19)10-23(20,21)9-13-6-4-3-5-7-13/h3-7H,9-10H2,1-2H3,(H,18,19)