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

Systemtic Name: 6-(benzotriazol-1-yl)-N4-(4-ethylphenyl)pyrimidine-4,5-diamine Openeye Name: 6-(benzotriazol-1-yl)-N4-(4-ethylphenyl)pyrimidine-4,5-diamine CAS Name: 6-(1-benzotriazolyl)-N4-(4-ethylphenyl)pyrimidine-4,5-diamine IUPAC Name: 6-(benzotriazol-1-yl)-4-N-(4-ethylphenyl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(benzotriazol-1-yl)pyrimidin-4-yl]-(4-ethylphenyl)amine Formula: C18H17N7 MolecularWeight: 331.37448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC=NC(=C2N)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H17N7/c1-2-12-7-9-13(10-8-12)22-17-16(19)18(21-11-20-17)25-15-6-4-3-5-14(15)23-24-25/h3-11H,2,19H2,1H3,(H,20,21,22)