5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-N-isopropyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(4-bromophenyl)sulfonylethylthio]-N-propan-2-yl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(4-bromophenyl)sulfonylethylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(2-brosylethylthio)-1,3,4-thiadiazol-2-yl]-isopropyl-amine Formula: C13H16BrN3O2S3 MolecularWeight: 422.38404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCCS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCCS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H16BrN3O2S3/c1-9(2)15-12-16-17-13(21-12)20-7-8-22(18,19)11-5-3-10(14)4-6-11/h3-6,9H,7-8H2,1-2H3,(H,15,16)