3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrrol-1-yl-propan-1-one

Systemtic Name: 3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrrol-1-yl-propan-1-one Openeye Name: 3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrrol-1-yl-propan-1-one CAS Name: 3-phenyl-1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-(1-pyrrolyl)-1-propanone IUPAC Name: 3-phenyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyrrol-1-ylpropan-1-one Traditional Name: 3-phenyl-1-[4-(2-pyrimidyl)piperazino]-2-pyrrol-1-yl-propan-1-one Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C(CC3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C(CC3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C21H23N5O/c27-20(25-13-15-26(16-14-25)21-22-9-6-10-23-21)19(24-11-4-5-12-24)17-18-7-2-1-3-8-18/h1-12,19H,13-17H2