N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-phenylpyridazin-3-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-phenylpyridazin-3-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-phenylpyridazin-3-yl)sulfanylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(6-phenylpyridazin-3-yl)thio]acetamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3S/c24-19(21-15-6-8-17-18(12-15)26-11-10-25-17)13-27-20-9-7-16(22-23-20)14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,21,24)