2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyl-1,2,3,4-tetrazol-5-yl)pyrimidine

Systemtic Name: 2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyl-1,2,3,4-tetrazol-5-yl)pyrimidine Openeye Name: 2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyltetrazol-5-yl)pyrimidine CAS Name: 2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyl-5-tetrazolyl)pyrimidine IUPAC Name: 2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyltetrazol-5-yl)pyrimidine Traditional Name: 2-tert-butyl-4-(3,4-dichlorophenyl)-5-(1-phenyltetrazol-5-yl)pyrimidine Formula: C21H18Cl2N6 MolecularWeight: 425.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C(=N1)C2=CC(=C(C=C2)Cl)Cl)C3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NC=C(C(=N1)C2=CC(=C(C=C2)Cl)Cl)C3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C21H18Cl2N6/c1-21(2,3)20-24-12-15(18(25-20)13-9-10-16(22)17(23)11-13)19-26-27-28-29(19)14-7-5-4-6-8-14/h4-12H,1-3H3