2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-N-prop-2-enylacetamide IUPAC Name: 2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[[4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C22H21FN4OS MolecularWeight: 408.491743

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

Isomeric SMILES

C=CCN(C1=CC=CC=C1)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H21FN4OS/c1-2-14-26(16-8-4-3-5-9-16)20(28)15-29-22-25-24-21(27(22)17-12-13-17)18-10-6-7-11-19(18)23/h2-11,17H,1,12-15H2