methyl 4-azanyl-7-(phenylmethyl)pyrrolo[2,3-d][1,2,3]triazine-5-carboximidate

Systemtic Name: methyl 4-azanyl-7-(phenylmethyl)pyrrolo[2,3-d][1,2,3]triazine-5-carboximidate Openeye Name: methyl 4-amino-7-benzyl-pyrrolo[2,3-d]triazine-5-carboximidate CAS Name: 4-amino-7-(phenylmethyl)-5-pyrrolo[2,3-d]triazinecarboximidic acid methyl ester IUPAC Name: methyl 4-amino-7-benzylpyrrolo[2,3-d]triazine-5-carboximidate Traditional Name: 4-amino-7-benzyl-pyrrolo[2,3-d]triazine-5-carboximidic acid methyl ester Formula: C14H14N6O MolecularWeight: 282.30056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=N)C1=CN(C2=C1C(=NN=N2)N)CC3=CC=CC=C3

Isomeric SMILES

COC(=N)C1=CN(C2=C1C(=NN=N2)N)CC3=CC=CC=C3

InChI

InChI=1S/C14H14N6O/c1-21-13(16)10-8-20(7-9-5-3-2-4-6-9)14-11(10)12(15)17-19-18-14/h2-6,8,16H,7H2,1H3,(H2,15,17,18)