N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[(3-cyano-2-pyridyl)sulfanyl]acetamide CAS Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-2-pyrrolyl]-2-[(3-cyano-2-pyridinyl)thio]acetamide IUPAC Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethylpyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanylacetamide Traditional Name: N-[3-cyano-1-(3-methoxypropyl)-4,5-dimethyl-pyrrol-2-yl]-2-[(3-cyano-2-pyridyl)thio]acetamide Formula: C19H21N5O2S MolecularWeight: 383.46734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O2S/c1-13-14(2)24(8-5-9-26-3)18(16(13)11-21)23-17(25)12-27-19-15(10-20)6-4-7-22-19/h4,6-7H,5,8-9,12H2,1-3H3,(H,23,25)