4-methyl-6-(2-methylpropyl)-2-[4-(4-phenylmethoxyphenyl)-1,2,3-triazol-1-yl]pyrimidine

Systemtic Name: 4-methyl-6-(2-methylpropyl)-2-[4-(4-phenylmethoxyphenyl)-1,2,3-triazol-1-yl]pyrimidine Openeye Name: 2-[4-(4-benzyloxyphenyl)triazol-1-yl]-4-isobutyl-6-methyl-pyrimidine CAS Name: 4-methyl-6-(2-methylpropyl)-2-[4-(4-phenylmethoxyphenyl)-1-triazolyl]pyrimidine IUPAC Name: 4-methyl-6-(2-methylpropyl)-2-[4-(4-phenylmethoxyphenyl)triazol-1-yl]pyrimidine Traditional Name: 2-[4-(4-benzoxyphenyl)triazol-1-yl]-4-isobutyl-6-methyl-pyrimidine Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=C(N=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)CC(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=C(N=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)CC(C)C

InChI

InChI=1S/C24H25N5O/c1-17(2)13-21-14-18(3)25-24(26-21)29-15-23(27-28-29)20-9-11-22(12-10-20)30-16-19-7-5-4-6-8-19/h4-12,14-15,17H,13,16H2,1-3H3