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

Systemtic Name: N-(2-ethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-fluorophenyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-ethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-fluorophenyl)triazole-4-carboxamide CAS Name: N-(2-ethylphenyl)-3-[(ethylthio)methyl]-5-(4-fluorophenyl)-4-triazolecarboxamide IUPAC Name: N-(2-ethylphenyl)-3-(ethylsulfanylmethyl)-5-(4-fluorophenyl)triazole-4-carboxamide Traditional Name: N-(2-ethylphenyl)-3-[(ethylthio)methyl]-5-(4-fluorophenyl)triazole-4-carboxamide Formula: C20H21FN4OS MolecularWeight: 384.470343

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=C(N=NN2CSCC)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=C(N=NN2CSCC)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4OS/c1-3-14-7-5-6-8-17(14)22-20(26)19-18(15-9-11-16(21)12-10-15)23-24-25(19)13-27-4-2/h5-12H,3-4,13H2,1-2H3,(H,22,26)