N-methyl-4-[[methyl-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]amino]methyl]benzamide

Systemtic Name: N-methyl-4-[[methyl-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoyl]amino]methyl]benzamide Openeye Name: N-methyl-4-[[methyl-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]methyl]benzamide CAS Name: N-methyl-4-[[methyl-[1-oxo-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethyl]amino]methyl]benzamide IUPAC Name: N-methyl-4-[[methyl-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetyl]amino]methyl]benzamide Traditional Name: N-methyl-4-[[methyl-[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]methyl]benzamide Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C18H19N5O2S2/c1-19-17(25)13-7-5-12(6-8-13)10-22(2)15(24)11-23-16(20-21-18(23)26)14-4-3-9-27-14/h3-9H,10-11H2,1-2H3,(H,19,25)(H,21,26)