N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethanamide

Systemtic Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]ethanamide Openeye Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]acetamide CAS Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-2-pyrrolyl]-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]acetamide IUPAC Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethylpyrrol-2-yl]-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]acetamide Traditional Name: N-[3-cyano-1-(3-fluorophenyl)-4,5-dimethyl-pyrrol-2-yl]-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]acetamide Formula: C27H27FN6O2 MolecularWeight: 486.540683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)C5=CC(=CC=C5)F)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCC(CC2)N3C4=CC=CC=C4NC3=O)C5=CC(=CC=C5)F)C

InChI

InChI=1S/C27H27FN6O2/c1-17-18(2)33(21-7-5-6-19(28)14-21)26(22(17)15-29)31-25(35)16-32-12-10-20(11-13-32)34-24-9-4-3-8-23(24)30-27(34)36/h3-9,14,20H,10-13,16H2,1-2H3,(H,30,36)(H,31,35)