6-tert-butyl-2-[4-(diphenylmethyl)piperazin-1-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-tert-butyl-2-[4-(diphenylmethyl)piperazin-1-yl]-1H-pyrimidin-4-one Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-6-tert-butyl-1H-pyrimidin-4-one CAS Name: 6-tert-butyl-2-[4-(diphenylmethyl)-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-6-tert-butyl-1H-pyrimidin-4-one Traditional Name: 2-(4-benzhydrylpiperazino)-6-tert-butyl-1H-pyrimidin-4-one Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)N=C(N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=O)N=C(N1)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O/c1-25(2,3)21-18-22(30)27-24(26-21)29-16-14-28(15-17-29)23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,18,23H,14-17H2,1-3H3,(H,26,27,30)