N-(3-chloranyl-4-methyl-phenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-(1-methylimidazol-4-yl)sulfonyl-isonipecotamide Formula: C17H21ClN4O3S MolecularWeight: 396.89164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=N3)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=N3)C)Cl

InChI

InChI=1S/C17H21ClN4O3S/c1-12-3-4-14(9-15(12)18)20-17(23)13-5-7-22(8-6-13)26(24,25)16-10-21(2)11-19-16/h3-4,9-11,13H,5-8H2,1-2H3,(H,20,23)