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

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C21H26N4O4S MolecularWeight: 430.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-2-16-6-3-4-8-19(16)24-20(26)15-23-21(27)17-9-12-25(13-10-17)30(28,29)18-7-5-11-22-14-18/h3-8,11,14,17H,2,9-10,12-13,15H2,1H3,(H,23,27)(H,24,26)