2-[4-(diphenylmethyl)piperazin-1-yl]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-5-isopentyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-6-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Traditional Name: 2-(4-benzhydrylpiperazino)-5-isoamyl-6-methyl-1H-pyrimidin-4-one Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)CCC(C)C

InChI

InChI=1S/C27H34N4O/c1-20(2)14-15-24-21(3)28-27(29-26(24)32)31-18-16-30(17-19-31)25(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-13,20,25H,14-19H2,1-3H3,(H,28,29,32)