(phenylmethyl) 4-methyl-6-sulfanylidene-2,3-dihydro-1H-pyridazine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-methyl-6-sulfanylidene-2,3-dihydro-1H-pyridazine-5-carboxylate Openeye Name: benzyl 4-methyl-6-thioxo-2,3-dihydro-1H-pyridazine-5-carboxylate CAS Name: 4-methyl-6-sulfanylidene-2,3-dihydro-1H-pyridazine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-6-sulfanylidene-2,3-dihydro-1H-pyridazine-5-carboxylate Traditional Name: 4-methyl-6-thioxo-2,3-dihydro-1H-pyridazine-5-carboxylic acid benzyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)NNC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=S)NNC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-9-7-14-15-12(18)11(9)13(16)17-8-10-5-3-2-4-6-10/h2-6,14H,7-8H2,1H3,(H,15,18)