N-[(3-chlorophenyl)methyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chlorobenzyl)-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H18ClN5OS MolecularWeight: 387.88642

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCC2=CC(=CC=C2)Cl)C3=CC=NC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCC2=CC(=CC=C2)Cl)C3=CC=NC=C3

InChI

InChI=1S/C18H18ClN5OS/c1-2-24-17(14-6-8-20-9-7-14)22-23-18(24)26-12-16(25)21-11-13-4-3-5-15(19)10-13/h3-10H,2,11-12H2,1H3,(H,21,25)