methyl 2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)ethanoate

Systemtic Name: methyl 2-(4-methyl-1-oxidanylidene-[1]benzothiolo[2,3-d]pyridazin-2-yl)ethanoate Openeye Name: methyl 2-(4-methyl-1-oxo-benzothiopheno[2,3-d]pyridazin-2-yl)acetate CAS Name: 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)acetic acid methyl ester IUPAC Name: methyl 2-(4-methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)acetate Traditional Name: 2-(1-keto-4-methyl-benzothiopheno[2,3-d]pyridazin-2-yl)acetic acid methyl ester Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CC(=O)OC

Isomeric SMILES

CC1=NN(C(=O)C2=C1SC3=CC=CC=C32)CC(=O)OC

InChI

InChI=1S/C14H12N2O3S/c1-8-13-12(9-5-3-4-6-10(9)20-13)14(18)16(15-8)7-11(17)19-2/h3-6H,7H2,1-2H3