6-[1-(5-chloranylthiophen-2-yl)butan-2-yl]-3-[cyclopropyl(phenyl)methyl]-2-oxidanyl-pyran-4-one

Systemtic Name: 6-[1-(5-chloranylthiophen-2-yl)butan-2-yl]-3-[cyclopropyl(phenyl)methyl]-2-oxidanyl-pyran-4-one Openeye Name: 6-[1-[(5-chloro-2-thienyl)methyl]propyl]-3-[cyclopropyl(phenyl)methyl]-2-hydroxy-pyran-4-one CAS Name: 6-[1-(5-chloro-2-thiophenyl)butan-2-yl]-3-[cyclopropyl(phenyl)methyl]-2-hydroxy-4-pyranone IUPAC Name: 6-[1-(5-chlorothiophen-2-yl)butan-2-yl]-3-[cyclopropyl(phenyl)methyl]-2-hydroxypyran-4-one Traditional Name: 6-[1-[(5-chloro-2-thienyl)methyl]propyl]-3-[cyclopropyl(phenyl)methyl]-2-hydroxy-pyran-4-one Formula: C23H23ClO3S MolecularWeight: 414.94492

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(S1)Cl)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CC=C4

Isomeric SMILES

CCC(CC1=CC=C(S1)Cl)C2=CC(=O)C(=C(O2)O)C(C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H23ClO3S/c1-2-14(12-17-10-11-20(24)28-17)19-13-18(25)22(23(26)27-19)21(16-8-9-16)15-6-4-3-5-7-15/h3-7,10-11,13-14,16,21,26H,2,8-9,12H2,1H3