1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-one

Systemtic Name: 1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-one Openeye Name: 1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-one CAS Name: 1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)thio]-2-propanone IUPAC Name: 1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-2-one Traditional Name: 1,3-bis[(4-phenyl-1,2,4-triazol-3-yl)thio]acetone Formula: C19H16N6OS2 MolecularWeight: 408.49994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=NN=C2SCC(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C19H16N6OS2/c26-17(11-27-18-22-20-13-24(18)15-7-3-1-4-8-15)12-28-19-23-21-14-25(19)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2