N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]benzamide

Systemtic Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]benzamide Openeye Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylpyridazin-3-yl]benzamide CAS Name: N-[6-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-3-pyridazinyl]benzamide IUPAC Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridazin-3-yl]benzamide Traditional Name: N-[6-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]pyridazin-3-yl]benzamide Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O4S/c25-18(21-14-6-7-15-16(10-14)28-12-27-15)11-29-19-9-8-17(23-24-19)22-20(26)13-4-2-1-3-5-13/h1-10H,11-12H2,(H,21,25)(H,22,23,26)