3,4-dimethoxy-N-[2-(2-oxidanylidenepropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[2-(2-oxidanylidenepropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Openeye Name: N-(2-acetonylsulfanyl-1,3-benzothiazol-6-yl)-3,4-dimethoxy-benzamide CAS Name: 3,4-dimethoxy-N-[2-(2-oxopropylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3,4-dimethoxy-N-[2-(2-oxopropylsulfanyl)-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-(acetonylthio)-1,3-benzothiazol-6-yl]-3,4-dimethoxy-benzamide Formula: C19H18N2O4S2 MolecularWeight: 402.48722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H18N2O4S2/c1-11(22)10-26-19-21-14-6-5-13(9-17(14)27-19)20-18(23)12-4-7-15(24-2)16(8-12)25-3/h4-9H,10H2,1-3H3,(H,20,23)