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

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=CC=C(C=C2)NC(=O)C)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=CC=C(C=C2)NC(=O)C)CC3=CC=CO3)C

InChI

InChI=1S/C22H22N4O3S/c1-14-15(2)26(12-18-5-4-10-29-18)22(20(14)11-23)25-21(28)13-30-19-8-6-17(7-9-19)24-16(3)27/h4-10H,12-13H2,1-3H3,(H,24,27)(H,25,28)