(2Z)-5,6-dimethyl-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-5,6-dimethyl-2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]benzofuran-3-one CAS Name: (2Z)-5,6-dimethyl-2-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-5,6-dimethyl-2-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-5,6-dimethyl-2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]coumaran-3-one Formula: C24H18N2O2S MolecularWeight: 398.47692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)O2)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)/C(=C/C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)/O2)C

InChI

InChI=1S/C24H18N2O2S/c1-15-11-19-20(12-16(15)2)28-21(24(19)27)13-17-14-26(18-7-4-3-5-8-18)25-23(17)22-9-6-10-29-22/h3-14H,1-2H3/b21-13-