N-[3-cyano-4-(3,4-dimethylphenyl)-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-cyano-4-(3,4-dimethylphenyl)-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-cyano-4-(3,4-dimethylphenyl)-5-methyl-2-thienyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-cyano-4-(3,4-dimethylphenyl)-5-methyl-2-thiophenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-cyano-4-(3,4-dimethylphenyl)-5-methylthiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-cyano-4-(3,4-dimethylphenyl)-5-methyl-2-thienyl]isonipecotamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3CCN(CC3)C(=O)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(SC(=C2C#N)NC(=O)C3CCN(CC3)C(=O)C)C)C

InChI

InChI=1S/C22H25N3O2S/c1-13-5-6-18(11-14(13)2)20-15(3)28-22(19(20)12-23)24-21(27)17-7-9-25(10-8-17)16(4)26/h5-6,11,17H,7-10H2,1-4H3,(H,24,27)