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

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1-phenylpyrazol-4-yl)ethanamide Openeye Name: 2-(1-phenylpyrazol-4-yl)-N-thiochroman-4-yl-acetamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-(1-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(1-phenylpyrazol-4-yl)-N-thiochroman-4-yl-acetamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1NC(=O)CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1CSC2=CC=CC=C2C1NC(=O)CC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3OS/c24-20(22-18-10-11-25-19-9-5-4-8-17(18)19)12-15-13-21-23(14-15)16-6-2-1-3-7-16/h1-9,13-14,18H,10-12H2,(H,22,24)