4-bromanyl-N-(4-ethylsulfanylphenyl)sulfonyl-2-methyl-benzamide

Systemtic Name: 4-bromanyl-N-(4-ethylsulfanylphenyl)sulfonyl-2-methyl-benzamide Openeye Name: 4-bromo-N-(4-ethylsulfanylphenyl)sulfonyl-2-methyl-benzamide CAS Name: 4-bromo-N-[4-(ethylthio)phenyl]sulfonyl-2-methylbenzamide IUPAC Name: 4-bromo-N-(4-ethylsulfanylphenyl)sulfonyl-2-methylbenzamide Traditional Name: 4-bromo-N-[4-(ethylthio)phenyl]sulfonyl-2-methyl-benzamide Formula: C16H16BrNO3S2 MolecularWeight: 414.33714

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C=C(C=C2)Br)C

Isomeric SMILES

CCSC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C16H16BrNO3S2/c1-3-22-13-5-7-14(8-6-13)23(20,21)18-16(19)15-9-4-12(17)10-11(15)2/h4-10H,3H2,1-2H3,(H,18,19)