4-ethoxy-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]benzamide

Systemtic Name: 4-ethoxy-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]benzamide Openeye Name: 4-ethoxy-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]benzamide CAS Name: 4-ethoxy-N-[[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethoxy-N-[(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)carbamothioyl]benzamide Traditional Name: 4-ethoxy-N-[[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]thiocarbamoyl]benzamide Formula: C14H17N5O2S2 MolecularWeight: 351.44708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NN2C(=NN=C2SC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NN2C(=NN=C2SC)C

InChI

InChI=1S/C14H17N5O2S2/c1-4-21-11-7-5-10(6-8-11)12(20)15-13(22)18-19-9(2)16-17-14(19)23-3/h5-8H,4H2,1-3H3,(H2,15,18,20,22)