3-[3-(3,4-dimethoxyphenyl)-4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanoic acid

Molecular Formula: C19H18N4O6S


InChI: InChI=1/C19H18N4O6S/c1-28-13-4-3-10(8-14(13)29-2)16-11(9-23(22-16)6-5-15(24)25)7-12-17(26)20-19(30)21-18(12)27/h3-4,7-9H,5-6H2,1-2H3,(H,24,25)(H2,20,21,26,27,30)/f/h20-21,24H

InChIKey: InChIKey=XPEFLRDEACRDKG-OOPQEEFJCG
SMILES: COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=S)NC3=O)CCC(=O)O)OC

Names:
    3-[3-(3,4-dimethoxyphenyl)-4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]pyrazol-1-yl]propanoic acid

Registries:
    PubChem CID 4463139
    PubChem ID 10187978