4-(3-azanyl-1H-1,2,4-triazol-5-yl)-N-(phenylmethyl)pyrimidin-2-amine

Systemtic Name: 4-(3-azanyl-1H-1,2,4-triazol-5-yl)-N-(phenylmethyl)pyrimidin-2-amine Openeye Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-benzyl-pyrimidin-2-amine CAS Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-(phenylmethyl)-2-pyrimidinamine IUPAC Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-benzylpyrimidin-2-amine Traditional Name: [4-(3-amino-1H-1,2,4-triazol-5-yl)pyrimidin-2-yl]-benzyl-amine Formula: C13H13N7 MolecularWeight: 267.28922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=CC(=N2)C3=NC(=NN3)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=CC(=N2)C3=NC(=NN3)N

InChI

InChI=1S/C13H13N7/c14-12-18-11(19-20-12)10-6-7-15-13(17-10)16-8-9-4-2-1-3-5-9/h1-7H,8H2,(H,15,16,17)(H3,14,18,19,20)