4-methyl-2,6-bis[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]cyclohexan-1-one

Systemtic Name: 4-methyl-2,6-bis[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]cyclohexan-1-one Openeye Name: 4-methyl-2,6-bis[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]cyclohexanone CAS Name: 4-methyl-2,6-bis[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]-1-cyclohexanone IUPAC Name: 4-methyl-2,6-bis[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]cyclohexan-1-one Traditional Name: 4-methyl-2,6-bis[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]cyclohexanone Formula: C35H28N4OS2 MolecularWeight: 584.75302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)C(=CC5=CN(N=C5C6=CC=CS6)C7=CC=CC=C7)C1

Isomeric SMILES

CC1CC(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)C(=CC5=CN(N=C5C6=CC=CS6)C7=CC=CC=C7)C1

InChI

InChI=1S/C35H28N4OS2/c1-24-18-25(20-27-22-38(29-10-4-2-5-11-29)36-33(27)31-14-8-16-41-31)35(40)26(19-24)21-28-23-39(30-12-6-3-7-13-30)37-34(28)32-15-9-17-42-32/h2-17,20-24H,18-19H2,1H3