[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone

Systemtic Name: [4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone Openeye Name: [4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone CAS Name: [4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-(4-pentylphenyl)methanone IUPAC Name: [4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-(4-pentylphenyl)methanone Traditional Name: (4-amylphenyl)-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazino]methanone Formula: C25H36N4O MolecularWeight: 408.57954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3C(C)C)C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3C(C)C)C)C

InChI

InChI=1S/C25H36N4O/c1-6-7-8-9-21-10-12-22(13-11-21)25(30)29-16-14-28(15-17-29)24-23(18(2)3)19(4)26-20(5)27-24/h10-13,18H,6-9,14-17H2,1-5H3