2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylidene]-1-benzothiophen-3-one

Systemtic Name: 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylidene]-1-benzothiophen-3-one Openeye Name: 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylene]benzothiophen-3-one CAS Name: 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenyl-4-pyrazolyl]methylidene]-1-benzothiophen-3-one IUPAC Name: 2-[[1-[(2,4-dichlorophenyl)methyl]-3-phenylpyrazol-4-yl]methylidene]-1-benzothiophen-3-one Traditional Name: 2-[[1-(2,4-dichlorobenzyl)-3-phenyl-pyrazol-4-yl]methylene]benzothiophen-3-one Formula: C25H16Cl2N2OS MolecularWeight: 463.37834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)C4=CC=CC=C4S3)CC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)C4=CC=CC=C4S3)CC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C25H16Cl2N2OS/c26-19-11-10-17(21(27)13-19)14-29-15-18(24(28-29)16-6-2-1-3-7-16)12-23-25(30)20-8-4-5-9-22(20)31-23/h1-13,15H,14H2