N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[3-ethoxy-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]thiophene-2-carboxamide Formula: C21H17FN4O2S MolecularWeight: 408.448683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=C(C=C2)F)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H17FN4O2S/c1-2-28-21-24-19(14-5-7-15(22)8-6-14)26(25-21)17-11-9-16(10-12-17)23-20(27)18-4-3-13-29-18/h3-13H,2H2,1H3,(H,23,27)