methyl 2-[6-[(3-fluorophenyl)carbonylamino]pyridazin-3-yl]sulfanylbutanoate

Systemtic Name: methyl 2-[6-[(3-fluorophenyl)carbonylamino]pyridazin-3-yl]sulfanylbutanoate Openeye Name: methyl 2-[6-[(3-fluorobenzoyl)amino]pyridazin-3-yl]sulfanylbutanoate CAS Name: 2-[[6-[[(3-fluorophenyl)-oxomethyl]amino]-3-pyridazinyl]thio]butanoic acid methyl ester IUPAC Name: methyl 2-[6-[(3-fluorobenzoyl)amino]pyridazin-3-yl]sulfanylbutanoate Traditional Name: 2-[[6-[(3-fluorobenzoyl)amino]pyridazin-3-yl]thio]butyric acid methyl ester Formula: C16H16FN3O3S MolecularWeight: 349.379943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)SC1=NN=C(C=C1)NC(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CCC(C(=O)OC)SC1=NN=C(C=C1)NC(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C16H16FN3O3S/c1-3-12(16(22)23-2)24-14-8-7-13(19-20-14)18-15(21)10-5-4-6-11(17)9-10/h4-9,12H,3H2,1-2H3,(H,18,19,21)