2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2-methyl-phenyl)acetamide CAS Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2-methylphenyl)acetamide IUPAC Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-chloro-2-methylphenyl)acetamide Traditional Name: 2-[(4-amino-5-butyl-1,2,4-triazol-3-yl)thio]-N-(5-chloro-2-methyl-phenyl)acetamide Formula: C15H20ClN5OS MolecularWeight: 353.8702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC(=O)NC2=C(C=CC(=C2)Cl)C

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC(=O)NC2=C(C=CC(=C2)Cl)C

InChI

InChI=1S/C15H20ClN5OS/c1-3-4-5-13-19-20-15(21(13)17)23-9-14(22)18-12-8-11(16)7-6-10(12)2/h6-8H,3-5,9,17H2,1-2H3,(H,18,22)