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

Systemtic Name: 4-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-bromophenyl)butan-1-one Openeye Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-bromophenyl)butan-1-one CAS Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(4-bromophenyl)-1-butanone IUPAC Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-bromophenyl)butan-1-one Traditional Name: 4-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-(4-bromophenyl)butan-1-one Formula: C12H12BrN3OS2 MolecularWeight: 358.27718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCSC2=NN=C(S2)N)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCSC2=NN=C(S2)N)Br

InChI

InChI=1S/C12H12BrN3OS2/c13-9-5-3-8(4-6-9)10(17)2-1-7-18-12-16-15-11(14)19-12/h3-6H,1-2,7H2,(H2,14,15)