2-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-cyclopentyl-5-(1-methylimidazol-2-yl)sulfanyl-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 2-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-2-cyclopentyl-5-(1-methylimidazol-2-yl)sulfanyl-6-oxidanyl-3H-pyran-4-one Openeye Name: 2-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-(1-methylimidazol-2-yl)sulfanyl-3H-pyran-4-one CAS Name: 2-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-[(1-methyl-2-imidazolyl)thio]-3H-pyran-4-one IUPAC Name: 2-[2-(3-chloro-4-methoxyphenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-(1-methylimidazol-2-yl)sulfanyl-3H-pyran-4-one Traditional Name: 2-[2-(3-chloro-4-methoxy-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-5-[(1-methylimidazol-2-yl)thio]-3H-pyran-4-one Formula: C23H27ClN2O4S MolecularWeight: 462.98948

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(OC(CC2=O)(CCC3=CC(=C(C=C3)OC)Cl)C4CCCC4)O

Isomeric SMILES

CN1C=CN=C1SC2=C(OC(CC2=O)(CCC3=CC(=C(C=C3)OC)Cl)C4CCCC4)O

InChI

InChI=1S/C23H27ClN2O4S/c1-26-12-11-25-22(26)31-20-18(27)14-23(30-21(20)28,16-5-3-4-6-16)10-9-15-7-8-19(29-2)17(24)13-15/h7-8,11-13,16,28H,3-6,9-10,14H2,1-2H3