N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,5-dimethyl-1-propan-2-yl-pyrrole-3-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,5-dimethyl-1-propan-2-yl-pyrrole-3-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-isopropyl-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2,5-dimethyl-1-propan-2-yl-3-pyrrolecarboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2,5-dimethyl-1-propan-2-ylpyrrole-3-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-1-isopropyl-2,5-dimethyl-pyrrole-3-carboxamide Formula: C19H25FN2OS MolecularWeight: 348.478003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)NCCSCC2=CC=CC=C2F

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)NCCSCC2=CC=CC=C2F

InChI

InChI=1S/C19H25FN2OS/c1-13(2)22-14(3)11-17(15(22)4)19(23)21-9-10-24-12-16-7-5-6-8-18(16)20/h5-8,11,13H,9-10,12H2,1-4H3,(H,21,23)