4-butyl-6-chloranyl-2-methyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidine

Systemtic Name: 4-butyl-6-chloranyl-2-methyl-5-[[4-phenyl-3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]pyrimidine Openeye Name: 4-butyl-6-chloro-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine CAS Name: 4-butyl-6-chloro-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine IUPAC Name: 4-butyl-6-chloro-2-methyl-5-[[4-phenyl-3-(2H-tetrazol-5-yl)phenyl]methyl]pyrimidine Traditional Name: 4-butyl-6-chloro-2-methyl-5-[4-phenyl-3-(2H-tetrazol-5-yl)benzyl]pyrimidine Formula: C23H23ClN6 MolecularWeight: 418.92192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=NC(=N1)C)Cl)CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

Isomeric SMILES

CCCCC1=C(C(=NC(=N1)C)Cl)CC2=CC(=C(C=C2)C3=CC=CC=C3)C4=NNN=N4

InChI

InChI=1S/C23H23ClN6/c1-3-4-10-21-20(22(24)26-15(2)25-21)14-16-11-12-18(17-8-6-5-7-9-17)19(13-16)23-27-29-30-28-23/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,27,28,29,30)