N-[(4-ethylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethylphenyl)methyl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-[(4-ethylphenyl)methyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-ethylphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-ethylbenzyl)-1-(4-methylpiperidino)sulfonyl-isonipecotamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C21H33N3O3S/c1-3-18-4-6-19(7-5-18)16-22-21(25)20-10-14-24(15-11-20)28(26,27)23-12-8-17(2)9-13-23/h4-7,17,20H,3,8-16H2,1-2H3,(H,22,25)