N-(4-tert-butylphenyl)-4-[3-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazin-1-amine

Systemtic Name: N-(4-tert-butylphenyl)-4-[3-(1,2,3,4-tetrazol-1-yl)phenyl]phthalazin-1-amine Openeye Name: N-(4-tert-butylphenyl)-4-[3-(tetrazol-1-yl)phenyl]phthalazin-1-amine CAS Name: N-(4-tert-butylphenyl)-4-[3-(1-tetrazolyl)phenyl]-1-phthalazinamine IUPAC Name: N-(4-tert-butylphenyl)-4-[3-(tetrazol-1-yl)phenyl]phthalazin-1-amine Traditional Name: (4-tert-butylphenyl)-[4-[3-(tetrazol-1-yl)phenyl]phthalazin-1-yl]amine Formula: C25H23N7 MolecularWeight: 421.49702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=CC=C4)N5C=NN=N5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=CC=C4)N5C=NN=N5

InChI

InChI=1S/C25H23N7/c1-25(2,3)18-11-13-19(14-12-18)27-24-22-10-5-4-9-21(22)23(28-29-24)17-7-6-8-20(15-17)32-16-26-30-31-32/h4-16H,1-3H3,(H,27,29)