N-[1-(3-cyanophenyl)carbonylpiperidin-4-yl]-3-[(2-methylphenyl)carbonylamino]pyrazine-2-carboxamide

Systemtic Name: N-[1-(3-cyanophenyl)carbonylpiperidin-4-yl]-3-[(2-methylphenyl)carbonylamino]pyrazine-2-carboxamide Openeye Name: N-[1-(3-cyanobenzoyl)-4-piperidyl]-3-[(2-methylbenzoyl)amino]pyrazine-2-carboxamide CAS Name: N-[1-[(3-cyanophenyl)-oxomethyl]-4-piperidinyl]-3-[[(2-methylphenyl)-oxomethyl]amino]-2-pyrazinecarboxamide IUPAC Name: N-[1-(3-cyanobenzoyl)piperidin-4-yl]-3-[(2-methylbenzoyl)amino]pyrazine-2-carboxamide Traditional Name: N-[1-(3-cyanobenzoyl)-4-piperidyl]-3-(o-toluoylamino)pyrazinamide Formula: C26H24N6O3 MolecularWeight: 468.50716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC=CN=C2C(=O)NC3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC=CN=C2C(=O)NC3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H24N6O3/c1-17-5-2-3-8-21(17)24(33)31-23-22(28-11-12-29-23)25(34)30-20-9-13-32(14-10-20)26(35)19-7-4-6-18(15-19)16-27/h2-8,11-12,15,20H,9-10,13-14H2,1H3,(H,30,34)(H,29,31,33)