2-(furan-2-yl)-N5-[1-(phenylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine

Systemtic Name: 2-(furan-2-yl)-N5-[1-(phenylmethyl)piperidin-4-yl]-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine Openeye Name: N5-(1-benzyl-4-piperidyl)-2-(2-furyl)-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine CAS Name: 2-(2-furanyl)-N5-[1-(phenylmethyl)-4-piperidinyl]-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine IUPAC Name: 5-N-(1-benzylpiperidin-4-yl)-2-(furan-2-yl)-[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine Traditional Name: [7-amino-2-(2-furyl)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-5-yl]-(1-benzyl-4-piperidyl)amine Formula: C20H22N8O MolecularWeight: 390.44168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=NC3=NC(=NN3C(=N2)N)C4=CC=CO4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC2=NC3=NC(=NN3C(=N2)N)C4=CC=CO4)CC5=CC=CC=C5

InChI

InChI=1S/C20H22N8O/c21-18-24-19(25-20-23-17(26-28(18)20)16-7-4-12-29-16)22-15-8-10-27(11-9-15)13-14-5-2-1-3-6-14/h1-7,12,15H,8-11,13H2,(H3,21,22,23,24,25,26)