5-[(3-bromophenyl)methylsulfanyl]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(3-bromophenyl)methylsulfanyl]-N-isobutyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-bromophenyl)methylthio]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(3-bromophenyl)methylsulfanyl]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(3-bromobenzyl)thio]-1,3,4-thiadiazol-2-yl]-isobutyl-amine Formula: C13H16BrN3S2 MolecularWeight: 358.32024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H16BrN3S2/c1-9(2)7-15-12-16-17-13(19-12)18-8-10-4-3-5-11(14)6-10/h3-6,9H,7-8H2,1-2H3,(H,15,16)