6-(benzotriazol-1-yl)-N4-(4-butylphenyl)pyrimidine-4,5-diamine

Systemtic Name: 6-(benzotriazol-1-yl)-N4-(4-butylphenyl)pyrimidine-4,5-diamine Openeye Name: 6-(benzotriazol-1-yl)-N4-(4-butylphenyl)pyrimidine-4,5-diamine CAS Name: 6-(1-benzotriazolyl)-N4-(4-butylphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(benzotriazol-1-yl)-4-N-(4-butylphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(benzotriazol-1-yl)pyrimidin-4-yl]-(4-butylphenyl)amine Formula: C20H21N7 MolecularWeight: 359.42764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H21N7/c1-2-3-6-14-9-11-15(12-10-14)24-19-18(21)20(23-13-22-19)27-17-8-5-4-7-16(17)25-26-27/h4-5,7-13H,2-3,6,21H2,1H3,(H,22,23,24)