N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: N-thiochroman-4-yl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: N-thiochroman-4-yl-2-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C17H21N3OS MolecularWeight: 315.43314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC(=O)NC2CCSC3=CC=CC=C23

Isomeric SMILES

CC1=C(C(=NN1C)C)CC(=O)NC2CCSC3=CC=CC=C23

InChI

InChI=1S/C17H21N3OS/c1-11-14(12(2)20(3)19-11)10-17(21)18-15-8-9-22-16-7-5-4-6-13(15)16/h4-7,15H,8-10H2,1-3H3,(H,18,21)