3-[6-oxidanyl-4-oxidanylidene-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]propylcarbamic acid

Systemtic Name: 3-[6-oxidanyl-4-oxidanylidene-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]propylcarbamic acid Openeye Name: 3-[6-hydroxy-5-(2-isopropylphenyl)sulfanyl-4-oxo-2-phenyl-3H-pyran-2-yl]propylcarbamic acid CAS Name: 3-[6-hydroxy-4-oxo-2-phenyl-5-[(2-propan-2-ylphenyl)thio]-3H-pyran-2-yl]propylcarbamic acid IUPAC Name: 3-[6-hydroxy-4-oxo-2-phenyl-5-(2-propan-2-ylphenyl)sulfanyl-3H-pyran-2-yl]propylcarbamic acid Traditional Name: 3-[6-hydroxy-4-keto-5-(o-cumenylthio)-2-phenyl-3H-pyran-2-yl]propylcarbamic acid Formula: C24H27NO5S MolecularWeight: 441.53988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CCCNC(=O)O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(CC2=O)(CCCNC(=O)O)C3=CC=CC=C3)O

InChI

InChI=1S/C24H27NO5S/c1-16(2)18-11-6-7-12-20(18)31-21-19(26)15-24(30-22(21)27,13-8-14-25-23(28)29)17-9-4-3-5-10-17/h3-7,9-12,16,25,27H,8,13-15H2,1-2H3,(H,28,29)