N-(2,3-dimethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2,3-dimethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2,3-dimethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide CAS Name: N-(2,3-dimethylphenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)-4-triazolecarboxamide IUPAC Name: N-(2,3-dimethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-methoxyphenyl)triazole-4-carboxamide Traditional Name: N-(2,3-dimethylphenyl)-3-[(ethylthio)methyl]-5-(4-methoxyphenyl)triazole-4-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)OC)C(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C21H24N4O2S/c1-5-28-13-25-20(21(26)22-18-8-6-7-14(2)15(18)3)19(23-24-25)16-9-11-17(27-4)12-10-16/h6-12H,5,13H2,1-4H3,(H,22,26)