N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[cyclopropyl-(4-methoxyphenyl)methyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C27H36N2O4S MolecularWeight: 484.65074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3CC3)C4=CC=C(C=C4)OC)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3CC3)C4=CC=C(C=C4)OC)C)C

InChI

InChI=1S/C27H36N2O4S/c1-17-16-18(2)20(4)26(19(17)3)34(31,32)29-14-12-23(13-15-29)27(30)28-25(21-6-7-21)22-8-10-24(33-5)11-9-22/h8-11,16,21,23,25H,6-7,12-15H2,1-5H3,(H,28,30)