N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)vinyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)ethenyl]-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-cyclopropyl-2-[[5-[(E)-2-(4-fluorophenyl)vinyl]-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H17FN4OS MolecularWeight: 332.395783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NNC(=N2)C=CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1CC1)SC2=NNC(=N2)/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4OS/c1-10(15(22)18-13-7-8-13)23-16-19-14(20-21-16)9-4-11-2-5-12(17)6-3-11/h2-6,9-10,13H,7-8H2,1H3,(H,18,22)(H,19,20,21)/b9-4+