N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-thiochroman-4-yl-acetamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-thiochroman-4-yl-acetamide Formula: C22H23N3OS MolecularWeight: 377.50252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NC3CCSC4=CC=CC=C34

InChI

InChI=1S/C22H23N3OS/c1-15-19(16(2)25(24-15)17-8-4-3-5-9-17)14-22(26)23-20-12-13-27-21-11-7-6-10-18(20)21/h3-11,20H,12-14H2,1-2H3,(H,23,26)