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

Systemtic Name: 6-butyl-2-methyl-3-phenethyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one Openeye Name: 6-butyl-2-methyl-3-phenethyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one CAS Name: 6-butyl-2-methyl-3-phenethyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]-4-pyrimidinone IUPAC Name: 6-butyl-2-methyl-3-phenethyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidin-4-one Traditional Name: 6-butyl-2-methyl-3-phenethyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidin-4-one Formula: C31H32N6O MolecularWeight: 504.62538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C)CCC2=CC=CC=C2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C)CCC2=CC=CC=C2)CC3=CC(=C(C=C3)C4=CC=CC=C4)C5=NNN=N5

InChI

InChI=1S/C31H32N6O/c1-3-4-15-29-28(31(38)37(22(2)32-29)19-18-23-11-7-5-8-12-23)21-24-16-17-26(25-13-9-6-10-14-25)27(20-24)30-33-35-36-34-30/h5-14,16-17,20H,3-4,15,18-19,21H2,1-2H3,(H,33,34,35,36)