N'-(4-acetamidophenyl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]ethanediamide

Systemtic Name: N'-(4-acetamidophenyl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-yl-ethyl]ethanediamide Openeye Name: N'-(4-acetamidophenyl)-N-[2-(4-phenylpiperazin-1-yl)-2-(3-pyridyl)ethyl]oxamide CAS Name: N'-(4-acetamidophenyl)-N-[2-(4-phenyl-1-piperazinyl)-2-(3-pyridinyl)ethyl]oxamide IUPAC Name: N'-(4-acetamidophenyl)-N-[2-(4-phenylpiperazin-1-yl)-2-pyridin-3-ylethyl]oxamide Traditional Name: N'-(4-acetamidophenyl)-N-[2-(4-phenylpiperazino)-2-(3-pyridyl)ethyl]oxamide Formula: C27H30N6O3 MolecularWeight: 486.5655

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=O)NCC(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=O)NCC(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N6O3/c1-20(34)30-22-9-11-23(12-10-22)31-27(36)26(35)29-19-25(21-6-5-13-28-18-21)33-16-14-32(15-17-33)24-7-3-2-4-8-24/h2-13,18,25H,14-17,19H2,1H3,(H,29,35)(H,30,34)(H,31,36)