(4-methyl-3-pyrrol-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-methyl-3-pyrrol-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4-methyl-3-pyrrol-1-yl-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [4-methyl-3-(1-pyrrolyl)phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-methyl-3-pyrrol-1-ylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4-methyl-3-pyrrol-1-yl-phenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)N4C=CC=C4

InChI

InChI=1S/C20H21N5O/c1-16-5-6-17(15-18(16)23-9-2-3-10-23)19(26)24-11-13-25(14-12-24)20-21-7-4-8-22-20/h2-10,15H,11-14H2,1H3