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

Systemtic Name: 3-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)propanamide Openeye Name: 3-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)propanamide CAS Name: 3-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-methoxyphenyl)propanamide IUPAC Name: 3-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)propanamide Traditional Name: 3-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(2-methoxyphenyl)propionamide Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CCSC2=NNC(=N2)C3CCCC3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CCSC2=NNC(=N2)C3CCCC3

InChI

InChI=1S/C17H22N4O2S/c1-23-14-9-5-4-8-13(14)18-15(22)10-11-24-17-19-16(20-21-17)12-6-2-3-7-12/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,18,22)(H,19,20,21)