6-cyclohexyl-N-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-4-oxidanylidene-1H-isothiochromene-1-carboxamide

Systemtic Name: 6-cyclohexyl-N-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-4-oxidanylidene-1H-isothiochromene-1-carboxamide Openeye Name: 6-cyclohexyl-N-[4-(diisopropoxyphosphorylmethyl)phenyl]-4-oxo-isothiochromane-1-carboxamide CAS Name: 6-cyclohexyl-N-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-4-oxo-1H-2-benzothiopyran-1-carboxamide IUPAC Name: 6-cyclohexyl-N-[4-[di(propan-2-yloxy)phosphorylmethyl]phenyl]-4-oxo-1H-isothiochromene-1-carboxamide Traditional Name: 6-cyclohexyl-N-[4-(diisopropoxyphosphorylmethyl)phenyl]-4-keto-isothiochroman-1-carboxamide Formula: C29H38NO5PS MolecularWeight: 543.654481

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(CC1=CC=C(C=C1)NC(=O)C2C3=C(C=C(C=C3)C4CCCCC4)C(=O)CS2)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(CC1=CC=C(C=C1)NC(=O)C2C3=C(C=C(C=C3)C4CCCCC4)C(=O)CS2)OC(C)C

InChI

InChI=1S/C29H38NO5PS/c1-19(2)34-36(33,35-20(3)4)17-21-10-13-24(14-11-21)30-29(32)28-25-15-12-23(22-8-6-5-7-9-22)16-26(25)27(31)18-37-28/h10-16,19-20,22,28H,5-9,17-18H2,1-4H3,(H,30,32)