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

Systemtic Name: 1-(4-bromophenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Openeye Name: 1-(4-bromophenyl)-2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-(4-bromophenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]thio]-1-propanone IUPAC Name: 1-(4-bromophenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propan-1-one Traditional Name: 1-(4-bromophenyl)-2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]thio]propan-1-one Formula: C14H16BrN3OS2 MolecularWeight: 386.33034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16BrN3OS2/c1-8(2)16-13-17-18-14(21-13)20-9(3)12(19)10-4-6-11(15)7-5-10/h4-9H,1-3H3,(H,16,17)