2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanyl-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]-N-[8-(methoxymethyl)-4H-1,3-benzodioxin-6-yl]benzamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC(=C3C(=C2)COCO3)COC

Isomeric SMILES

CN(C)C(=O)CSC1=CC=CC=C1C(=O)NC2=CC(=C3C(=C2)COCO3)COC

InChI

InChI=1S/C21H24N2O5S/c1-23(2)19(24)12-29-18-7-5-4-6-17(18)21(25)22-16-8-14(10-26-3)20-15(9-16)11-27-13-28-20/h4-9H,10-13H2,1-3H3,(H,22,25)