2-butyl-5,6-dimethyl-3-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one

Systemtic Name: 2-butyl-5,6-dimethyl-3-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one Openeye Name: 2-butyl-5,6-dimethyl-3-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one CAS Name: 2-butyl-5,6-dimethyl-3-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]-4-pyrimidinone IUPAC Name: 2-butyl-5,6-dimethyl-3-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one Traditional Name: 2-butyl-5,6-dimethyl-3-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidin-4-one Formula: C24H26N6O MolecularWeight: 414.50284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)C)C

Isomeric SMILES

CCCCC1=NC(=C(C(=O)N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4)C)C

InChI

InChI=1S/C24H26N6O/c1-4-5-11-22-25-17(3)16(2)24(31)30(22)15-18-12-13-20(19-9-7-6-8-10-19)21(14-18)23-26-28-29-27-23/h6-10,12-14H,4-5,11,15H2,1-3H3,(H,26,27,28,29)