1,3,5-trimethyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide

Systemtic Name: 1,3,5-trimethyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Openeye Name: 1,3,5-trimethyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide CAS Name: 1,3,5-trimethyl-N-[2-(phenylthio)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1,3,5-trimethyl-N-(2-phenylsulfanylethyl)pyrazole-4-carboxamide Traditional Name: 1,3,5-trimethyl-N-[2-(phenylthio)ethyl]pyrazole-4-carboxamide Formula: C15H19N3OS MolecularWeight: 289.39586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C15H19N3OS/c1-11-14(12(2)18(3)17-11)15(19)16-9-10-20-13-7-5-4-6-8-13/h4-8H,9-10H2,1-3H3,(H,16,19)