2-[(4-azanyl-5-pentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-pentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[(4-amino-5-pentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[(4-amino-5-pentyl-1,2,4-triazol-3-yl)thio]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[(4-amino-5-pentyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[(4-amino-5-amyl-1,2,4-triazol-3-yl)thio]-N-(2,3-dimethylphenyl)acetamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(N1N)SCC(=O)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCCC1=NN=C(N1N)SCC(=O)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C17H25N5OS/c1-4-5-6-10-15-20-21-17(22(15)18)24-11-16(23)19-14-9-7-8-12(2)13(14)3/h7-9H,4-6,10-11,18H2,1-3H3,(H,19,23)