4-[(4-chlorophenyl)methyl]-N-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-methyl-5-thioxo-1H-1,2,4-triazole-3-carboxamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-methyl-5-sulfanylidene-1H-1,2,4-triazole-3-carboxamide Traditional Name: 4-(4-chlorobenzyl)-N-methyl-5-thioxo-1H-1,2,4-triazole-3-carboxamide Formula: C11H11ClN4OS MolecularWeight: 282.74924

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NNC(=S)N1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CNC(=O)C1=NNC(=S)N1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H11ClN4OS/c1-13-10(17)9-14-15-11(18)16(9)6-7-2-4-8(12)5-3-7/h2-5H,6H2,1H3,(H,13,17)(H,15,18)