2-[(4-bromophenyl)sulfonylamino]-N-(4-methylpyridin-2-yl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-N-(4-methylpyridin-2-yl)-4-methylsulfanyl-butanamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-N-(4-methyl-2-pyridyl)-4-methylsulfanyl-butanamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-N-(4-methyl-2-pyridinyl)-4-(methylthio)butanamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-N-(4-methylpyridin-2-yl)-4-methylsulfanylbutanamide Traditional Name: 2-(brosylamino)-N-(4-methyl-2-pyridyl)-4-(methylthio)butyramide Formula: C17H20BrN3O3S2 MolecularWeight: 458.393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H20BrN3O3S2/c1-12-7-9-19-16(11-12)20-17(22)15(8-10-25-2)21-26(23,24)14-5-3-13(18)4-6-14/h3-7,9,11,15,21H,8,10H2,1-2H3,(H,19,20,22)