N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(p-tolylsulfonyl)acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-tosyl-acetamide Formula: C16H13BrN2O3S2 MolecularWeight: 425.32002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

InChI=1S/C16H13BrN2O3S2/c1-10-2-5-12(6-3-10)24(21,22)9-15(20)19-16-18-13-7-4-11(17)8-14(13)23-16/h2-8H,9H2,1H3,(H,18,19,20)