methyl 4-[4-azanyl-6-[(3,4-dimethylphenyl)amino]-1,3,5-triazin-2-yl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-azanyl-6-[(3,4-dimethylphenyl)amino]-1,3,5-triazin-2-yl]-3-oxidanylidene-butanoate Openeye Name: methyl 4-[4-amino-6-(3,4-dimethylanilino)-1,3,5-triazin-2-yl]-3-oxo-butanoate CAS Name: 4-[4-amino-6-(3,4-dimethylanilino)-1,3,5-triazin-2-yl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-amino-6-(3,4-dimethylanilino)-1,3,5-triazin-2-yl]-3-oxobutanoate Traditional Name: 4-[4-amino-6-(3,4-dimethylanilino)-s-triazin-2-yl]-3-keto-butyric acid methyl ester Formula: C16H19N5O3 MolecularWeight: 329.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)N)CC(=O)CC(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)N)CC(=O)CC(=O)OC)C

InChI

InChI=1S/C16H19N5O3/c1-9-4-5-11(6-10(9)2)18-16-20-13(19-15(17)21-16)7-12(22)8-14(23)24-3/h4-6H,7-8H2,1-3H3,(H3,17,18,19,20,21)