1-(4-bromophenyl)-3-(4-chlorophenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(4-bromophenyl)-3-(4-chlorophenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(4-bromophenyl)-3-(4-chlorophenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(4-bromophenyl)-3-[(4-chlorophenyl)thio]-2-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(4-bromophenyl)-3-(4-chlorophenyl)sulfanyl-2-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(4-bromophenyl)-3-[(4-chlorophenyl)thio]-2-(1,2,4-triazol-1-yl)propan-1-one Formula: C17H13BrClN3OS MolecularWeight: 422.72662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C(CSC2=CC=C(C=C2)Cl)N3C=NC=N3)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)C(CSC2=CC=C(C=C2)Cl)N3C=NC=N3)Br

InChI

InChI=1S/C17H13BrClN3OS/c18-13-3-1-12(2-4-13)17(23)16(22-11-20-10-21-22)9-24-15-7-5-14(19)6-8-15/h1-8,10-11,16H,9H2