(3-phenylcyclohex-3-en-1-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3-phenylcyclohex-3-en-1-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3-phenylcyclohex-3-en-1-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (3-phenyl-1-cyclohex-3-enyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (3-phenylcyclohex-3-en-1-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3-phenylcyclohex-3-en-1-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H24N4O MolecularWeight: 348.44146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(=C1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC(CC(=C1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H24N4O/c26-20(19-9-4-8-18(16-19)17-6-2-1-3-7-17)24-12-14-25(15-13-24)21-22-10-5-11-23-21/h1-3,5-8,10-11,19H,4,9,12-16H2