2-[2-(5-chloranylthiophen-3-yl)-4-cyclohexyl-phenyl]-2-methyl-4,5-bis(oxidanyl)furan-3-one

Systemtic Name: 2-[2-(5-chloranylthiophen-3-yl)-4-cyclohexyl-phenyl]-2-methyl-4,5-bis(oxidanyl)furan-3-one Openeye Name: 2-[2-(5-chloro-3-thienyl)-4-cyclohexyl-phenyl]-4,5-dihydroxy-2-methyl-furan-3-one CAS Name: 2-[2-(5-chloro-3-thiophenyl)-4-cyclohexylphenyl]-4,5-dihydroxy-2-methyl-3-furanone IUPAC Name: 2-[2-(5-chlorothiophen-3-yl)-4-cyclohexylphenyl]-4,5-dihydroxy-2-methylfuran-3-one Traditional Name: 2-[2-(5-chloro-3-thienyl)-4-cyclohexyl-phenyl]-4,5-dihydroxy-2-methyl-furan-3-one Formula: C21H21ClO4S MolecularWeight: 404.90704

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)O)O)C2=C(C=C(C=C2)C3CCCCC3)C4=CSC(=C4)Cl

Isomeric SMILES

CC1(C(=O)C(=C(O1)O)O)C2=C(C=C(C=C2)C3CCCCC3)C4=CSC(=C4)Cl

InChI

InChI=1S/C21H21ClO4S/c1-21(19(24)18(23)20(25)26-21)16-8-7-13(12-5-3-2-4-6-12)9-15(16)14-10-17(22)27-11-14/h7-12,23,25H,2-6H2,1H3