N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=NN=C2SCC(=O)NC3(CCCC3)C#N

Isomeric SMILES

COC1=CC=CC(=C1)N2C=NN=C2SCC(=O)NC3(CCCC3)C#N

InChI

InChI=1S/C17H19N5O2S/c1-24-14-6-4-5-13(9-14)22-12-19-21-16(22)25-10-15(23)20-17(11-18)7-2-3-8-17/h4-6,9,12H,2-3,7-8,10H2,1H3,(H,20,23)