(5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-imidazolidin-4-one

Systemtic Name: (5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-sulfanylidene-imidazolidin-4-one Openeye Name: (5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-thioxo-imidazolidin-4-one CAS Name: (5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylidene]-2-sulfanylidene-4-imidazolidinone IUPAC Name: (5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylideneimidazolidin-4-one Traditional Name: (5Z)-5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-thioxo-4-imidazolidinone Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=C4C(=O)NC(=S)N4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3/C=C\4/C(=O)NC(=S)N4)C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O3S/c26-20-16(22-21(29)23-20)10-14-12-25(15-4-2-1-3-5-15)24-19(14)13-6-7-17-18(11-13)28-9-8-27-17/h1-7,10-12H,8-9H2,(H2,22,23,26,29)/b16-10-