N-[(4-chlorophenyl)methyl]-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-[(1-methyl-4-imidazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-(1-methylimidazol-4-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-1-(1-methylimidazol-4-yl)sulfonyl-nipecotamide Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H21ClN4O3S/c1-21-11-16(20-12-21)26(24,25)22-8-2-3-14(10-22)17(23)19-9-13-4-6-15(18)7-5-13/h4-7,11-12,14H,2-3,8-10H2,1H3,(H,19,23)