N-(3-chloranyl-4-methoxy-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-1-(1H-imidazol-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-1-(1H-imidazol-5-ylsulfonyl)isonipecotamide Formula: C16H19ClN4O4S MolecularWeight: 398.86446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3)Cl

InChI

InChI=1S/C16H19ClN4O4S/c1-25-14-3-2-12(8-13(14)17)20-16(22)11-4-6-21(7-5-11)26(23,24)15-9-18-10-19-15/h2-3,8-11H,4-7H2,1H3,(H,18,19)(H,20,22)