2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-N-(2-pyrrol-1-ylphenyl)ethanamide

Systemtic Name: 2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-N-(2-pyrrol-1-ylphenyl)ethanamide Openeye Name: 2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-N-(2-pyrrol-1-ylphenyl)acetamide CAS Name: 2-[4-[4-(3-methylphenoxy)-2-pyrimidinyl]-1-piperazinyl]-N-[2-(1-pyrrolyl)phenyl]acetamide IUPAC Name: 2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-N-(2-pyrrol-1-ylphenyl)acetamide Traditional Name: 2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazino]-N-(2-pyrrol-1-ylphenyl)acetamide Formula: C27H28N6O2 MolecularWeight: 468.55022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)CC(=O)NC4=CC=CC=C4N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)CC(=O)NC4=CC=CC=C4N5C=CC=C5

InChI

InChI=1S/C27H28N6O2/c1-21-7-6-8-22(19-21)35-26-11-12-28-27(30-26)33-17-15-31(16-18-33)20-25(34)29-23-9-2-3-10-24(23)32-13-4-5-14-32/h2-14,19H,15-18,20H2,1H3,(H,29,34)