N-(1,3-benzodioxol-5-yl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(4-bromo-2,5-dimethylphenyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(4-bromo-2,5-dimethylphenyl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetamide Formula: C17H16BrNO3S MolecularWeight: 394.28284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16BrNO3S/c1-10-6-16(11(2)5-13(10)18)23-8-17(20)19-12-3-4-14-15(7-12)22-9-21-14/h3-7H,8-9H2,1-2H3,(H,19,20)