1-[1-[(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclopentyl]urea

Systemtic Name: 1-[1-[(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclopentyl]urea Openeye Name: [1-[(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclopentyl]urea CAS Name: [1-[[6-hydroxy-4-oxo-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]methyl]cyclopentyl]urea IUPAC Name: [1-[(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclopentyl]urea Traditional Name: [1-[[6-hydroxy-4-keto-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]methyl]cyclopentyl]urea Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CC2(CC(=O)C(=C(O2)O)SCCC3=CC=CC=C3)C4=CC=CC=C4)NC(=O)N

Isomeric SMILES

C1CCC(C1)(CC2(CC(=O)C(=C(O2)O)SCCC3=CC=CC=C3)C4=CC=CC=C4)NC(=O)N

InChI

InChI=1S/C26H30N2O4S/c27-24(31)28-25(14-7-8-15-25)18-26(20-11-5-2-6-12-20)17-21(29)22(23(30)32-26)33-16-13-19-9-3-1-4-10-19/h1-6,9-12,30H,7-8,13-18H2,(H3,27,28,31)