[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 2-cyclopropylquinoline-4-carboxylate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 2-cyclopropylquinoline-4-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 2-cyclopropylquinoline-4-carboxylate CAS Name: 2-cyclopropyl-4-quinolinecarboxylic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 2-cyclopropylquinoline-4-carboxylate Traditional Name: 2-cyclopropylcinchoninic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C17H16N6O2 MolecularWeight: 336.34794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C17H16N6O2/c18-16-21-14(22-17(19)23-16)8-25-15(24)11-7-13(9-5-6-9)20-12-4-2-1-3-10(11)12/h1-4,7,9H,5-6,8H2,(H4,18,19,21,22,23)