6,7-bis(chloranyl)-2-cyclopentyl-2-methyl-5-(4-pyridin-4-ylsulfanylbutoxy)-3H-inden-1-one

Systemtic Name: 6,7-bis(chloranyl)-2-cyclopentyl-2-methyl-5-(4-pyridin-4-ylsulfanylbutoxy)-3H-inden-1-one Openeye Name: 6,7-dichloro-2-cyclopentyl-2-methyl-5-[4-(4-pyridylsulfanyl)butoxy]indan-1-one CAS Name: 6,7-dichloro-2-cyclopentyl-2-methyl-5-[4-(pyridin-4-ylthio)butoxy]-3H-inden-1-one IUPAC Name: 6,7-dichloro-2-cyclopentyl-2-methyl-5-(4-pyridin-4-ylsulfanylbutoxy)-3H-inden-1-one Traditional Name: 6,7-dichloro-2-cyclopentyl-2-methyl-5-[4-(4-pyridylthio)butoxy]indan-1-one Formula: C24H27Cl2NO2S MolecularWeight: 464.44768

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCCSC3=CC=NC=C3)C4CCCC4

Isomeric SMILES

CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCCCCSC3=CC=NC=C3)C4CCCC4

InChI

InChI=1S/C24H27Cl2NO2S/c1-24(17-6-2-3-7-17)15-16-14-19(21(25)22(26)20(16)23(24)28)29-12-4-5-13-30-18-8-10-27-11-9-18/h8-11,14,17H,2-7,12-13,15H2,1H3