N-(4-ethoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-ethoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(5-methyl-4-phenethyl-1,2,4-triazol-3-yl)thio]-N-p-phenetyl-acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CCC3=CC=CC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CCC3=CC=CC=C3)C

InChI

InChI=1S/C21H24N4O2S/c1-3-27-19-11-9-18(10-12-19)22-20(26)15-28-21-24-23-16(2)25(21)14-13-17-7-5-4-6-8-17/h4-12H,3,13-15H2,1-2H3,(H,22,26)