1-(4-bromophenyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-(4-bromophenyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-(4-bromophenyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-(4-bromophenyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C15H18BrN3OS2 MolecularWeight: 400.35692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SC(C)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN3OS2/c1-9(2)8-17-14-18-19-15(22-14)21-10(3)13(20)11-4-6-12(16)7-5-11/h4-7,9-10H,8H2,1-3H3,(H,17,18)