2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-thienyl)ethanone CAS Name: 2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-thiophen-2-ylethanone IUPAC Name: 2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-ylethanone Traditional Name: 2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(2-thienyl)ethanone Formula: C14H12N4OS2 MolecularWeight: 316.40128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=CC=CS2)C3=CC=NC=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=CC=CS2)C3=CC=NC=C3

InChI

InChI=1S/C14H12N4OS2/c1-18-13(10-4-6-15-7-5-10)16-17-14(18)21-9-11(19)12-3-2-8-20-12/h2-8H,9H2,1H3