N5-(2-azanylpropyl)-N7-phenyl-3-propan-2-yl-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-diamine

Systemtic Name: N5-(2-azanylpropyl)-N7-phenyl-3-propan-2-yl-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-diamine Openeye Name: N5-(2-aminopropyl)-3-isopropyl-N7-phenyl-triazolo[4,5-d]pyrimidine-5,7-diamine CAS Name: N5-(2-aminopropyl)-N7-phenyl-3-propan-2-yltriazolo[4,5-d]pyrimidine-5,7-diamine IUPAC Name: 5-N-(2-aminopropyl)-7-N-phenyl-3-propan-2-yltriazolo[4,5-d]pyrimidine-5,7-diamine Traditional Name: 2-aminopropyl-(7-anilino-3-isopropyl-triazolo[4,5-d]pyrimidin-5-yl)amine Formula: C16H22N8 MolecularWeight: 326.39948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC(=N2)NCC(C)N)NC3=CC=CC=C3)N=N1

Isomeric SMILES

CC(C)N1C2=C(C(=NC(=N2)NCC(C)N)NC3=CC=CC=C3)N=N1

InChI

InChI=1S/C16H22N8/c1-10(2)24-15-13(22-23-24)14(19-12-7-5-4-6-8-12)20-16(21-15)18-9-11(3)17/h4-8,10-11H,9,17H2,1-3H3,(H2,18,19,20,21)