N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-[(3,5-dimethyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-(3,5-dimethylpiperidino)sulfonyl-nipecotamide Formula: C21H32ClN3O3S MolecularWeight: 442.01508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H32ClN3O3S/c1-16-12-17(2)14-25(13-16)29(27,28)24-11-3-4-19(15-24)21(26)23-10-9-18-5-7-20(22)8-6-18/h5-8,16-17,19H,3-4,9-15H2,1-2H3,(H,23,26)