1-[2-(4-bromophenyl)-3-sulfanylidene-1H-1,2,4-triazol-5-yl]propan-2-one

Systemtic Name: 1-[2-(4-bromophenyl)-3-sulfanylidene-1H-1,2,4-triazol-5-yl]propan-2-one Openeye Name: 1-[2-(4-bromophenyl)-3-thioxo-1H-1,2,4-triazol-5-yl]propan-2-one CAS Name: 1-[2-(4-bromophenyl)-3-sulfanylidene-1H-1,2,4-triazol-5-yl]-2-propanone IUPAC Name: 1-[2-(4-bromophenyl)-3-sulfanylidene-1H-1,2,4-triazol-5-yl]propan-2-one Traditional Name: 1-[2-(4-bromophenyl)-3-thioxo-1H-1,2,4-triazol-5-yl]acetone Formula: C11H10BrN3OS MolecularWeight: 312.1856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=NC(=S)N(N1)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(=O)CC1=NC(=S)N(N1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C11H10BrN3OS/c1-7(16)6-10-13-11(17)15(14-10)9-4-2-8(12)3-5-9/h2-5H,6H2,1H3,(H,13,14,17)