N-[3-(cyclopropylcarbamoyl)phenyl]-1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(3-fluorophenyl)-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[3-(cyclopropylcarbamoyl)phenyl]-1-(3-fluorophenyl)-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C23H18FN5O2S MolecularWeight: 447.484723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=NN(C(=N3)C4=CC=CS4)C5=CC(=CC=C5)F

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)C3=NN(C(=N3)C4=CC=CS4)C5=CC(=CC=C5)F

InChI

InChI=1S/C23H18FN5O2S/c24-15-5-2-7-18(13-15)29-21(19-8-3-11-32-19)27-20(28-29)23(31)26-17-6-1-4-14(12-17)22(30)25-16-9-10-16/h1-8,11-13,16H,9-10H2,(H,25,30)(H,26,31)