N-[4-methyl-3-(2-oxidanylidenepiperidin-1-yl)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-methyl-3-(2-oxidanylidenepiperidin-1-yl)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-methyl-3-(2-oxo-1-piperidyl)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-methyl-3-(2-oxo-1-piperidinyl)phenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-methyl-3-(2-oxopiperidin-1-yl)phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(2-ketopiperidino)-4-methyl-phenyl]-1-mesyl-isonipecotamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C)N3CCCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C)N3CCCCC3=O

InChI

InChI=1S/C19H27N3O4S/c1-14-6-7-16(13-17(14)22-10-4-3-5-18(22)23)20-19(24)15-8-11-21(12-9-15)27(2,25)26/h6-7,13,15H,3-5,8-12H2,1-2H3,(H,20,24)