N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)triazole-4-carboxamide CAS Name: N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-[(methylthio)methyl]-4-triazolecarboxamide IUPAC Name: N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-(methylsulfanylmethyl)triazole-4-carboxamide Traditional Name: N-(2-ethylphenyl)-5-(4-methoxyphenyl)-3-[(methylthio)methyl]triazole-4-carboxamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=C(N=NN2CSC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=C(N=NN2CSC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N4O2S/c1-4-14-7-5-6-8-17(14)21-20(25)19-18(22-23-24(19)13-27-3)15-9-11-16(26-2)12-10-15/h5-12H,4,13H2,1-3H3,(H,21,25)