2-oxidanyl-4-oxidanylidene-6-phenethyl-6-phenyl-3-(2H-pyran-3-ylsulfanylmethyl)cyclohex-2-ene-1-carbonitrile

Systemtic Name: 2-oxidanyl-4-oxidanylidene-6-phenethyl-6-phenyl-3-(2H-pyran-3-ylsulfanylmethyl)cyclohex-2-ene-1-carbonitrile Openeye Name: 2-hydroxy-4-oxo-6-phenethyl-6-phenyl-3-(2H-pyran-3-ylsulfanylmethyl)cyclohex-2-ene-1-carbonitrile CAS Name: 2-hydroxy-4-oxo-6-phenethyl-6-phenyl-3-[(2H-pyran-3-ylthio)methyl]-1-cyclohex-2-enecarbonitrile IUPAC Name: 2-hydroxy-4-oxo-6-phenethyl-6-phenyl-3-(2H-pyran-3-ylsulfanylmethyl)cyclohex-2-ene-1-carbonitrile Traditional Name: 2-hydroxy-4-keto-6-phenethyl-6-phenyl-3-[(2H-pyran-3-ylthio)methyl]cyclohex-2-ene-1-carbonitrile Formula: C27H25NO3S MolecularWeight: 443.5573

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(C(C1(CCC2=CC=CC=C2)C3=CC=CC=C3)C#N)O)CSC4=CC=COC4

Isomeric SMILES

C1C(=O)C(=C(C(C1(CCC2=CC=CC=C2)C3=CC=CC=C3)C#N)O)CSC4=CC=COC4

InChI

InChI=1S/C27H25NO3S/c28-17-24-26(30)23(19-32-22-12-7-15-31-18-22)25(29)16-27(24,21-10-5-2-6-11-21)14-13-20-8-3-1-4-9-20/h1-12,15,24,30H,13-14,16,18-19H2