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

Systemtic Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(phenylsulfonyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-[4-(benzenesulfonyl)-1-piperazinyl]-N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-(4-besylpiperazino)-N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CO4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CO4)C

InChI

InChI=1S/C24H27N5O4S/c1-18-19(2)29(16-20-7-6-14-33-20)24(22(18)15-25)26-23(30)17-27-10-12-28(13-11-27)34(31,32)21-8-4-3-5-9-21/h3-9,14H,10-13,16-17H2,1-2H3,(H,26,30)