N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-5-cyclopropyl-1H-pyrazole-3-carboxamide Formula: C17H18N4OS MolecularWeight: 326.41602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC1C2=CC(=NN2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H18N4OS/c18-10-13-3-1-2-4-14(13)11-23-8-7-19-17(22)16-9-15(20-21-16)12-5-6-12/h1-4,9,12H,5-8,11H2,(H,19,22)(H,20,21)