5-[(4-tert-butylphenyl)methyl]-6-methyl-2-[4-(phenylmethyl)piperazin-1-yl]-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-tert-butylphenyl)methyl]-6-methyl-2-[4-(phenylmethyl)piperazin-1-yl]-1H-pyrimidin-4-one Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(4-tert-butylphenyl)methyl]-6-methyl-2-[4-(phenylmethyl)-1-piperazinyl]-1H-pyrimidin-4-one IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-[(4-tert-butylphenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(4-benzylpiperazino)-5-(4-tert-butylbenzyl)-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)CC3=CC=CC=C3)CC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCN(CC2)CC3=CC=CC=C3)CC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H34N4O/c1-20-24(18-21-10-12-23(13-11-21)27(2,3)4)25(32)29-26(28-20)31-16-14-30(15-17-31)19-22-8-6-5-7-9-22/h5-13H,14-19H2,1-4H3,(H,28,29,32)