4-chloranyl-N-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzamide

Systemtic Name: 4-chloranyl-N-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 4-chloro-N-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 4-chloro-N-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzamide IUPAC Name: 4-chloro-N-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 4-chloro-N-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]benzamide Formula: C12H13ClN4OS MolecularWeight: 296.77582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)CNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCN1C(=NNC1=S)CNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H13ClN4OS/c1-2-17-10(15-16-12(17)19)7-14-11(18)8-3-5-9(13)6-4-8/h3-6H,2,7H2,1H3,(H,14,18)(H,16,19)