2-[2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)ethanoylamino]benzamide

Systemtic Name: 2-[2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)ethanoylamino]benzamide Openeye Name: 2-[[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)acetyl]amino]benzamide CAS Name: 2-[[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)acetyl]amino]benzamide Traditional Name: 2-[[2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]acetyl]amino]benzamide Formula: C12H14N6O2S MolecularWeight: 306.34356

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC(=O)NC2=CC=CC=C2C(=O)N)N

Isomeric SMILES

CSC1=NN=C(N1CC(=O)NC2=CC=CC=C2C(=O)N)N

InChI

InChI=1S/C12H14N6O2S/c1-21-12-17-16-11(14)18(12)6-9(19)15-8-5-3-2-4-7(8)10(13)20/h2-5H,6H2,1H3,(H2,13,20)(H2,14,16)(H,15,19)