1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[(4-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[(4-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide Openeye Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[phenyl(p-tolyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[(4-methylphenyl)-phenylmethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2,4-dichlorophenyl)methylsulfonyl]-N-[(4-methylphenyl)-phenylmethyl]piperidine-3-carboxamide Traditional Name: 1-(2,4-dichlorobenzyl)sulfonyl-N-[phenyl(p-tolyl)methyl]nipecotamide Formula: C27H28Cl2N2O3S MolecularWeight: 531.49382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C27H28Cl2N2O3S/c1-19-9-11-21(12-10-19)26(20-6-3-2-4-7-20)30-27(32)22-8-5-15-31(17-22)35(33,34)18-23-13-14-24(28)16-25(23)29/h2-4,6-7,9-14,16,22,26H,5,8,15,17-18H2,1H3,(H,30,32)