N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-methylsulfonyl-pyrrolidine-1-carboxamide

Systemtic Name: N-[5-[4-(4-cyanophenyl)piperidin-1-yl]carbonyl-2-methyl-phenyl]-3-methylsulfonyl-pyrrolidine-1-carboxamide Openeye Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-methylsulfonyl-pyrrolidine-1-carboxamide CAS Name: N-[5-[[4-(4-cyanophenyl)-1-piperidinyl]-oxomethyl]-2-methylphenyl]-3-methylsulfonyl-1-pyrrolidinecarboxamide IUPAC Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methylphenyl]-3-methylsulfonylpyrrolidine-1-carboxamide Traditional Name: N-[5-[4-(4-cyanophenyl)piperidine-1-carbonyl]-2-methyl-phenyl]-3-mesyl-pyrrolidine-1-carboxamide Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)N4CCC(C4)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=CC=C(C=C3)C#N)NC(=O)N4CCC(C4)S(=O)(=O)C

InChI

InChI=1S/C26H30N4O4S/c1-18-3-6-22(15-24(18)28-26(32)30-14-11-23(17-30)35(2,33)34)25(31)29-12-9-21(10-13-29)20-7-4-19(16-27)5-8-20/h3-8,15,21,23H,9-14,17H2,1-2H3,(H,28,32)