N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-(benzofuran-2-yl)ethyl]-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanyl-acetamide CAS Name: N-[(1S)-1-(2-benzofuranyl)ethyl]-2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]acetamide IUPAC Name: N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanylacetamide Traditional Name: N-[(1S)-1-(benzofuran-2-yl)ethyl]-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]acetamide Formula: C23H23N3O2S MolecularWeight: 405.51262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)NC(C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)SCC(=O)N[C@@H](C)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H23N3O2S/c1-15(21-13-18-9-7-8-12-20(18)28-21)24-22(27)14-29-23-16(2)25-26(17(23)3)19-10-5-4-6-11-19/h4-13,15H,14H2,1-3H3,(H,24,27)/t15-/m0/s1