N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(2-pyridylsulfanyl)acetamide CAS Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-2-pyrrolyl)-2-(2-pyridinylthio)acetamide IUPAC Name: N-(3-cyano-1-cyclopentyl-4,5-dimethylpyrrol-2-yl)-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-(2-pyridylthio)acetamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=CC=CC=N2)C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=CC=CC=N2)C3CCCC3)C

InChI

InChI=1S/C19H22N4OS/c1-13-14(2)23(15-7-3-4-8-15)19(16(13)11-20)22-17(24)12-25-18-9-5-6-10-21-18/h5-6,9-10,15H,3-4,7-8,12H2,1-2H3,(H,22,24)