N-(3-imidazol-1-ylpropyl)-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-mesyl-isonipecotamide Formula: C13H22N4O3S MolecularWeight: 314.40378

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NCCCN2C=CN=C2

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NCCCN2C=CN=C2

InChI

InChI=1S/C13H22N4O3S/c1-21(19,20)17-8-3-12(4-9-17)13(18)15-5-2-7-16-10-6-14-11-16/h6,10-12H,2-5,7-9H2,1H3,(H,15,18)