N-[(3-chlorophenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-chlorobenzyl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C14H17ClN4OS MolecularWeight: 324.82898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H17ClN4OS/c1-2-4-12-17-18-14(21)19(12)9-13(20)16-8-10-5-3-6-11(15)7-10/h3,5-7H,2,4,8-9H2,1H3,(H,16,20)(H,18,21)