[4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-(4-methylphenyl)methanone Openeye Name: [4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-(p-tolyl)methanone CAS Name: [4-[[2-(4-ethoxyanilino)-3-pyridinyl]-oxomethyl]-1-piperazinyl]-(4-methylphenyl)methanone IUPAC Name: [4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-(4-methylphenyl)methanone Traditional Name: [4-[2-(p-phenetidino)nicotinoyl]piperazino]-(p-tolyl)methanone Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H28N4O3/c1-3-33-22-12-10-21(11-13-22)28-24-23(5-4-14-27-24)26(32)30-17-15-29(16-18-30)25(31)20-8-6-19(2)7-9-20/h4-14H,3,15-18H2,1-2H3,(H,27,28)