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

Systemtic Name: 6-butyl-3-methyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]-2-propan-2-yl-pyrimidin-4-one Openeye Name: 6-butyl-2-isopropyl-3-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one CAS Name: 6-butyl-3-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]-2-propan-2-yl-4-pyrimidinone IUPAC Name: 6-butyl-3-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]-2-propan-2-ylpyrimidin-4-one Traditional Name: 6-butyl-2-isopropyl-3-methyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidin-4-one Formula: C26H30N6O MolecularWeight: 442.556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C(C)C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C(C)C)C)CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

InChI

InChI=1S/C26H30N6O/c1-5-6-12-23-22(26(33)32(4)25(27-23)17(2)3)16-18-13-14-20(19-10-8-7-9-11-19)21(15-18)24-28-30-31-29-24/h7-11,13-15,17H,5-6,12,16H2,1-4H3,(H,28,29,30,31)