2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chlorophenyl)propanamide

Systemtic Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chlorophenyl)propanamide Openeye Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chlorophenyl)propanamide CAS Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(3-chlorophenyl)propanamide IUPAC Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-chlorophenyl)propanamide Traditional Name: 2-[(5-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(3-chlorophenyl)propionamide Formula: C15H19ClN4OS MolecularWeight: 338.85556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1)SC(C)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCC1=NC(=NN1)SC(C)C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H19ClN4OS/c1-3-4-8-13-18-15(20-19-13)22-10(2)14(21)17-12-7-5-6-11(16)9-12/h5-7,9-10H,3-4,8H2,1-2H3,(H,17,21)(H,18,19,20)