3,4-dihydro-2H-thiochromen-2-yl(1H-pyrazol-4-yl)methanone

Systemtic Name: 3,4-dihydro-2H-thiochromen-2-yl(1H-pyrazol-4-yl)methanone Openeye Name: 1H-pyrazol-4-yl(thiochroman-2-yl)methanone CAS Name: 3,4-dihydro-2H-1-benzothiopyran-2-yl(1H-pyrazol-4-yl)methanone IUPAC Name: 3,4-dihydro-2H-thiochromen-2-yl(1H-pyrazol-4-yl)methanone Traditional Name: 1H-pyrazol-4-yl(thiochroman-2-yl)methanone Formula: C13H12N2OS MolecularWeight: 244.31218

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2SC1C(=O)C3=CNN=C3

Isomeric SMILES

C1CC2=CC=CC=C2SC1C(=O)C3=CNN=C3

InChI

InChI=1S/C13H12N2OS/c16-13(10-7-14-15-8-10)12-6-5-9-3-1-2-4-11(9)17-12/h1-4,7-8,12H,5-6H2,(H,14,15)