2-[(4-bromophenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-4-(methylthio)-N-(1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfanyl-N-(1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 2-(brosylamino)-4-(methylthio)-N-(1,3,4-thiadiazol-2-yl)butyramide Formula: C13H15BrN4O3S3 MolecularWeight: 451.3822

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=NN=CS1)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CSCCC(C(=O)NC1=NN=CS1)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN4O3S3/c1-22-7-6-11(12(19)16-13-17-15-8-23-13)18-24(20,21)10-4-2-9(14)3-5-10/h2-5,8,11,18H,6-7H2,1H3,(H,16,17,19)