5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-(ethylsulfanylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-(ethylsulfanylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-(ethylsulfanylmethyl)triazole-4-carboxamide CAS Name: 5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-[(ethylthio)methyl]-4-triazolecarboxamide IUPAC Name: 5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-(ethylsulfanylmethyl)triazole-4-carboxamide Traditional Name: 5-(3,4-dimethoxyphenyl)-N-(4-ethylphenyl)-3-[(ethylthio)methyl]triazole-4-carboxamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSCC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSCC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H26N4O3S/c1-5-15-7-10-17(11-8-15)23-22(27)21-20(24-25-26(21)14-30-6-2)16-9-12-18(28-3)19(13-16)29-4/h7-13H,5-6,14H2,1-4H3,(H,23,27)