N-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-5-(2-thienyl)triazole-4-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-3-[(methylthio)methyl]-5-thiophen-2-yl-4-triazolecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-3-(methylsulfanylmethyl)-5-thiophen-2-yltriazole-4-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-3-[(methylthio)methyl]-5-(2-thienyl)triazole-4-carboxamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(N=NN2CSC)C3=CC=CS3)OC

InChI

InChI=1S/C17H18N4O3S2/c1-23-12-7-6-11(9-13(12)24-2)18-17(22)16-15(14-5-4-8-26-14)19-20-21(16)10-25-3/h4-9H,10H2,1-3H3,(H,18,22)