1-[5-azanyl-6-azanylidene-3-[(4-methylphenyl)amino]-1,2,4-triazin-1-yl]ethanone

Systemtic Name: 1-[5-azanyl-6-azanylidene-3-[(4-methylphenyl)amino]-1,2,4-triazin-1-yl]ethanone Openeye Name: 1-[5-amino-6-imino-3-(4-methylanilino)-1,2,4-triazin-1-yl]ethanone CAS Name: 1-[5-amino-6-imino-3-(4-methylanilino)-1,2,4-triazin-1-yl]ethanone IUPAC Name: 1-[5-amino-6-imino-3-(4-methylanilino)-1,2,4-triazin-1-yl]ethanone Traditional Name: 1-[5-amino-6-imino-3-(p-toluidino)-1,2,4-triazin-1-yl]ethanone Formula: C12H14N6O MolecularWeight: 258.27916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN(C(=N)C(=N2)N)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN(C(=N)C(=N2)N)C(=O)C

InChI

InChI=1S/C12H14N6O/c1-7-3-5-9(6-4-7)15-12-16-10(13)11(14)18(17-12)8(2)19/h3-6,14H,1-2H3,(H3,13,15,16,17)