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

Systemtic Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H15N5O2S MolecularWeight: 317.3662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=NN=C2SCC(=O)NCCC#N

Isomeric SMILES

COC1=CC=CC(=C1)N2C=NN=C2SCC(=O)NCCC#N

InChI

InChI=1S/C14H15N5O2S/c1-21-12-5-2-4-11(8-12)19-10-17-18-14(19)22-9-13(20)16-7-3-6-15/h2,4-5,8,10H,3,7,9H2,1H3,(H,16,20)