1-(4-bromophenyl)-2-[(5,6-dithiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[(5,6-dithiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone Openeye Name: 2-[[5,6-bis(2-thienyl)-1,2,4-triazin-3-yl]sulfanyl]-1-(4-bromophenyl)ethanone CAS Name: 1-(4-bromophenyl)-2-[(5,6-dithiophen-2-yl-1,2,4-triazin-3-yl)thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[(5,6-dithiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanone Traditional Name: 2-[[5,6-bis(2-thienyl)-1,2,4-triazin-3-yl]thio]-1-(4-bromophenyl)ethanone Formula: C19H12BrN3OS3 MolecularWeight: 474.41708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=C(N=NC(=N2)SCC(=O)C3=CC=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1=CSC(=C1)C2=C(N=NC(=N2)SCC(=O)C3=CC=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C19H12BrN3OS3/c20-13-7-5-12(6-8-13)14(24)11-27-19-21-17(15-3-1-9-25-15)18(22-23-19)16-4-2-10-26-16/h1-10H,11H2