[2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[(4,5-dimethyl-1-oxidanylidene-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4,5-dimethyl-1-oxo-2H-furo[3,4-d]pyridazin-7-yl)amino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-keto-2-[(1-keto-4,5-dimethyl-2H-furo[3,4-d]pyridazin-7-yl)amino]ethyl] ester Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)COC(=O)C3=C(N=CC=C3)SC)C

Isomeric SMILES

CC1=C2C(=NNC(=O)C2=C(O1)NC(=O)COC(=O)C3=C(N=CC=C3)SC)C

InChI

InChI=1S/C17H16N4O5S/c1-8-12-9(2)26-15(13(12)14(23)21-20-8)19-11(22)7-25-17(24)10-5-4-6-18-16(10)27-3/h4-6H,7H2,1-3H3,(H,19,22)(H,21,23)