ethyl 2-(6-benzamidopyridazin-3-yl)sulfanylbutanoate

Systemtic Name: ethyl 2-(6-benzamidopyridazin-3-yl)sulfanylbutanoate Openeye Name: ethyl 2-(6-benzamidopyridazin-3-yl)sulfanylbutanoate CAS Name: 2-[(6-benzamido-3-pyridazinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-(6-benzamidopyridazin-3-yl)sulfanylbutanoate Traditional Name: 2-[(6-benzamidopyridazin-3-yl)thio]butyric acid ethyl ester Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S/c1-3-13(17(22)23-4-2)24-15-11-10-14(19-20-15)18-16(21)12-8-6-5-7-9-12/h5-11,13H,3-4H2,1-2H3,(H,18,19,21)