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

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

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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

Isomeric SMILES

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

InChI

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