N-methyl-1-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-methyl-1-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-methyl-1-[3-(3-oxopiperazin-1-yl)sulfonylbenzoyl]piperidine-4-carboxamide CAS Name: N-methyl-1-[oxo-[3-[(3-oxo-1-piperazinyl)sulfonyl]phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[3-(3-oxopiperazin-1-yl)sulfonylbenzoyl]piperidine-4-carboxamide Traditional Name: 1-[3-(3-ketopiperazino)sulfonylbenzoyl]-N-methyl-isonipecotamide Formula: C18H24N4O5S MolecularWeight: 408.47196

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CNC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C18H24N4O5S/c1-19-17(24)13-5-8-21(9-6-13)18(25)14-3-2-4-15(11-14)28(26,27)22-10-7-20-16(23)12-22/h2-4,11,13H,5-10,12H2,1H3,(H,19,24)(H,20,23)