3-[4,5-bis(azanyl)-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide

Systemtic Name: 3-[4,5-bis(azanyl)-1,2,4-triazol-3-yl]-N-(4-methylphenyl)propanamide Openeye Name: 3-(4,5-diamino-1,2,4-triazol-3-yl)-N-(p-tolyl)propanamide CAS Name: 3-(4,5-diamino-1,2,4-triazol-3-yl)-N-(4-methylphenyl)propanamide IUPAC Name: 3-(4,5-diamino-1,2,4-triazol-3-yl)-N-(4-methylphenyl)propanamide Traditional Name: 3-(4,5-diamino-1,2,4-triazol-3-yl)-N-(p-tolyl)propionamide Formula: C12H16N6O MolecularWeight: 260.29504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC2=NN=C(N2N)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC2=NN=C(N2N)N

InChI

InChI=1S/C12H16N6O/c1-8-2-4-9(5-3-8)15-11(19)7-6-10-16-17-12(13)18(10)14/h2-5H,6-7,14H2,1H3,(H2,13,17)(H,15,19)