2-(1,3-dithiolan-2-ylidene)-1-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)ethanone

Systemtic Name: 2-(1,3-dithiolan-2-ylidene)-1-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)ethanone Openeye Name: 2-(1,3-dithiolan-2-ylidene)-1-(p-tolyl)-2-(1,2,4-triazol-1-yl)ethanone CAS Name: 2-(1,3-dithiolan-2-ylidene)-1-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)ethanone IUPAC Name: 2-(1,3-dithiolan-2-ylidene)-1-(4-methylphenyl)-2-(1,2,4-triazol-1-yl)ethanone Traditional Name: 2-(1,3-dithiolan-2-ylidene)-1-(p-tolyl)-2-(1,2,4-triazol-1-yl)ethanone Formula: C14H13N3OS2 MolecularWeight: 303.40252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=C2SCCS2)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(=C2SCCS2)N3C=NC=N3

InChI

InChI=1S/C14H13N3OS2/c1-10-2-4-11(5-3-10)13(18)12(14-19-6-7-20-14)17-9-15-8-16-17/h2-5,8-9H,6-7H2,1H3