N-[6-[4-(2-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[6-[4-(2-methylphenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenoxy-ethanamide Openeye Name: N-[6-[4-(2-methylbenzoyl)piperazin-1-yl]-3-pyridyl]-2-phenoxy-acetamide CAS Name: N-[6-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-2-phenoxyacetamide IUPAC Name: N-[6-[4-(2-methylbenzoyl)piperazin-1-yl]pyridin-3-yl]-2-phenoxyacetamide Traditional Name: N-[6-(4-o-toluoylpiperazino)-3-pyridyl]-2-phenoxy-acetamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c1-19-7-5-6-10-22(19)25(31)29-15-13-28(14-16-29)23-12-11-20(17-26-23)27-24(30)18-32-21-8-3-2-4-9-21/h2-12,17H,13-16,18H2,1H3,(H,27,30)