N-(1-methylpyrazol-3-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(1-methylpyrazol-3-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(1-methyl-3-pyrazolyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(1-methylpyrazol-3-yl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(1-methylpyrazol-3-yl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C13H14N6OS2 MolecularWeight: 334.41986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CN1C=CC(=N1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C13H14N6OS2/c1-18-6-4-10(17-18)14-11(20)5-7-19-12(15-16-13(19)21)9-3-2-8-22-9/h2-4,6,8H,5,7H2,1H3,(H,16,21)(H,14,17,20)