(3Z)-3-[[1-(phenylmethyl)pyrazol-4-yl]methylidene]thiochromen-4-one

Systemtic Name: (3Z)-3-[[1-(phenylmethyl)pyrazol-4-yl]methylidene]thiochromen-4-one Openeye Name: (3Z)-3-[(1-benzylpyrazol-4-yl)methylene]thiochroman-4-one CAS Name: (3Z)-3-[[1-(phenylmethyl)-4-pyrazolyl]methylidene]-1-benzothiopyran-4-one IUPAC Name: (3Z)-3-[(1-benzylpyrazol-4-yl)methylidene]thiochromen-4-one Traditional Name: (3Z)-3-[(1-benzylpyrazol-4-yl)methylene]thiochroman-4-one Formula: C20H16N2OS MolecularWeight: 332.41884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CN(N=C2)CC3=CC=CC=C3)C(=O)C4=CC=CC=C4S1

Isomeric SMILES

C1/C(=C\C2=CN(N=C2)CC3=CC=CC=C3)/C(=O)C4=CC=CC=C4S1

InChI

InChI=1S/C20H16N2OS/c23-20-17(14-24-19-9-5-4-8-18(19)20)10-16-11-21-22(13-16)12-15-6-2-1-3-7-15/h1-11,13H,12,14H2/b17-10+