N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C20H23ClN4O4S MolecularWeight: 450.93902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H23ClN4O4S/c1-14-17(21)5-2-6-18(14)24-19(26)13-23-20(27)15-7-10-25(11-8-15)30(28,29)16-4-3-9-22-12-16/h2-6,9,12,15H,7-8,10-11,13H2,1H3,(H,23,27)(H,24,26)