2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-5-methylsulfanyl-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-methylsulfanyl-benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(methylthio)benzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-methylsulfanylbenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-chloro-5-(methylthio)benzamide Formula: C17H14ClNO4S MolecularWeight: 363.81536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)SC)Cl)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3=C(C=CC(=C3)SC)Cl)OCO2

InChI

InChI=1S/C17H14ClNO4S/c1-9(20)11-6-15-16(23-8-22-15)7-14(11)19-17(21)12-5-10(24-2)3-4-13(12)18/h3-7H,8H2,1-2H3,(H,19,21)