3-phenethyl-5-phenyl-N-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

Systemtic Name: 3-phenethyl-5-phenyl-N-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: N-benzyl-3-phenethyl-5-phenyl-triazolo[4,5-d]pyrimidin-7-amine CAS Name: 3-phenethyl-5-phenyl-N-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: N-benzyl-3-phenethyl-5-phenyltriazolo[4,5-d]pyrimidin-7-amine Traditional Name: benzyl-(3-phenethyl-5-phenyl-triazolo[4,5-d]pyrimidin-7-yl)amine Formula: C25H22N6 MolecularWeight: 406.48238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=C(C(=NC(=N3)C4=CC=CC=C4)NCC5=CC=CC=C5)N=N2

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=C(C(=NC(=N3)C4=CC=CC=C4)NCC5=CC=CC=C5)N=N2

InChI

InChI=1S/C25H22N6/c1-4-10-19(11-5-1)16-17-31-25-22(29-30-31)24(26-18-20-12-6-2-7-13-20)27-23(28-25)21-14-8-3-9-15-21/h1-15H,16-18H2,(H,26,27,28)