5-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-N-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-N-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-(3,4-dimethoxyphenyl)-N-(4-isopropylphenyl)-3-(methylsulfanylmethyl)triazole-4-carboxamide CAS Name: 5-(3,4-dimethoxyphenyl)-3-[(methylthio)methyl]-N-(4-propan-2-ylphenyl)-4-triazolecarboxamide IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-N-(4-propan-2-ylphenyl)triazole-4-carboxamide Traditional Name: 5-(3,4-dimethoxyphenyl)-3-[(methylthio)methyl]-N-p-cumenyl-triazole-4-carboxamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H26N4O3S/c1-14(2)15-6-9-17(10-7-15)23-22(27)21-20(24-25-26(21)13-30-5)16-8-11-18(28-3)19(12-16)29-4/h6-12,14H,13H2,1-5H3,(H,23,27)