N-[6-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]propanamide

Systemtic Name: N-[6-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]propanamide Openeye Name: N-[6-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]sulfanylpyridazin-3-yl]propanamide CAS Name: N-[6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]thio]-3-pyridazinyl]propanamide IUPAC Name: N-[6-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]sulfanylpyridazin-3-yl]propanamide Traditional Name: N-[6-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]thio]pyridazin-3-yl]propionamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NN=C(C=C1)SCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC(=O)NC1=NN=C(C=C1)SCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H18N4O4S/c1-2-15(22)19-14-5-6-17(21-20-14)26-10-16(23)18-11-3-4-12-13(9-11)25-8-7-24-12/h3-6,9H,2,7-8,10H2,1H3,(H,18,23)(H,19,20,22)