1-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-N,N-dimethyl-6-oxidanylidene-pyridine-3-sulfonamide

Systemtic Name: 1-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-N,N-dimethyl-6-oxidanylidene-pyridine-3-sulfonamide Openeye Name: 1-[[2-(3-bromophenyl)thiazol-4-yl]methyl]-N,N-dimethyl-6-oxo-pyridine-3-sulfonamide CAS Name: 1-[[2-(3-bromophenyl)-4-thiazolyl]methyl]-N,N-dimethyl-6-oxo-3-pyridinesulfonamide IUPAC Name: 1-[[2-(3-bromophenyl)-1,3-thiazol-4-yl]methyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide Traditional Name: 1-[[2-(3-bromophenyl)thiazol-4-yl]methyl]-6-keto-N,N-dimethyl-pyridine-3-sulfonamide Formula: C17H16BrN3O3S2 MolecularWeight: 454.36124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)CC2=CSC(=N2)C3=CC(=CC=C3)Br

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)CC2=CSC(=N2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H16BrN3O3S2/c1-20(2)26(23,24)15-6-7-16(22)21(10-15)9-14-11-25-17(19-14)12-4-3-5-13(18)8-12/h3-8,10-11H,9H2,1-2H3