N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-(4-methylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-[(4-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]-2-[(4-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]-2-(4-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]-2-[(4-methyl-2-quinolyl)thio]acetamide Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=C(C(=C(N3CC4=CC=CO4)C)C)C#N

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NC3=C(C(=C(N3CC4=CC=CO4)C)C)C#N

InChI

InChI=1S/C24H22N4O2S/c1-15-11-23(26-21-9-5-4-8-19(15)21)31-14-22(29)27-24-20(12-25)16(2)17(3)28(24)13-18-7-6-10-30-18/h4-11H,13-14H2,1-3H3,(H,27,29)