4-(isoquinolin-5-ylamino)-5-methyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid

Systemtic Name: 4-(isoquinolin-5-ylamino)-5-methyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Openeye Name: 4-(5-isoquinolylamino)-5-methyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid CAS Name: 4-(5-isoquinolinylamino)-5-methyl-6-pyrrolo[2,1-f][1,2,4]triazinecarboxylic acid IUPAC Name: 4-(isoquinolin-5-ylamino)-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Traditional Name: 4-(5-isoquinolylamino)-5-methyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid Formula: C17H13N5O2 MolecularWeight: 319.31742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NC=NN2C=C1C(=O)O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C2C(=NC=NN2C=C1C(=O)O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C17H13N5O2/c1-10-13(17(23)24)8-22-15(10)16(19-9-20-22)21-14-4-2-3-11-7-18-6-5-12(11)14/h2-9H,1H3,(H,23,24)(H,19,20,21)