(E)-3-(3-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(3-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(3-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(3-bromophenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(3-bromophenyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)acrylamide Formula: C17H13BrN2O3S2 MolecularWeight: 437.33072

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC(=CC=C3)Br

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)/C=C/C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H13BrN2O3S2/c1-25(22,23)13-6-7-14-15(10-13)24-17(19-14)20-16(21)8-5-11-3-2-4-12(18)9-11/h2-10H,1H3,(H,19,20,21)/b8-5+