2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-phenyl-5-[2-(4-propoxyphenyl)ethyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)N

InChI

InChI=1S/C21H24N4O2S/c1-2-14-27-18-11-8-16(9-12-18)10-13-20-23-24-21(28-15-19(22)26)25(20)17-6-4-3-5-7-17/h3-9,11-12H,2,10,13-15H2,1H3,(H2,22,26)