6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-oxidanylidene-1H-isothiochromene-1-carboxamide

Systemtic Name: 6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-oxidanylidene-1H-isothiochromene-1-carboxamide Openeye Name: 6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-oxo-isothiochromane-1-carboxamide CAS Name: 6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-oxo-1H-2-benzothiopyran-1-carboxamide IUPAC Name: 6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-oxo-1H-isothiochromene-1-carboxamide Traditional Name: 6-cyclohexyl-N-(4-diethoxyphosphorylphenyl)-4-keto-isothiochroman-1-carboxamide Formula: C26H32NO5PS MolecularWeight: 501.574741

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(C=C1)NC(=O)C2C3=C(C=C(C=C3)C4CCCCC4)C(=O)CS2)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(C=C1)NC(=O)C2C3=C(C=C(C=C3)C4CCCCC4)C(=O)CS2)OCC

InChI

InChI=1S/C26H32NO5PS/c1-3-31-33(30,32-4-2)21-13-11-20(12-14-21)27-26(29)25-22-15-10-19(18-8-6-5-7-9-18)16-23(22)24(28)17-34-25/h10-16,18,25H,3-9,17H2,1-2H3,(H,27,29)