4-chloranyl-3-(4-methylsulfonylphenyl)-2-(4-pyrrolidin-1-ylphenyl)-2H-furan-5-one

Systemtic Name: 4-chloranyl-3-(4-methylsulfonylphenyl)-2-(4-pyrrolidin-1-ylphenyl)-2H-furan-5-one Openeye Name: 4-chloro-3-(4-methylsulfonylphenyl)-2-(4-pyrrolidin-1-ylphenyl)-2H-furan-5-one CAS Name: 4-chloro-3-(4-methylsulfonylphenyl)-2-[4-(1-pyrrolidinyl)phenyl]-2H-furan-5-one IUPAC Name: 4-chloro-3-(4-methylsulfonylphenyl)-2-(4-pyrrolidin-1-ylphenyl)-2H-furan-5-one Traditional Name: 4-chloro-3-(4-mesylphenyl)-2-(4-pyrrolidinophenyl)-2H-furan-5-one Formula: C21H20ClNO4S MolecularWeight: 417.9058

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2C3=CC=C(C=C3)N4CCCC4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2C3=CC=C(C=C3)N4CCCC4)Cl

InChI

InChI=1S/C21H20ClNO4S/c1-28(25,26)17-10-6-14(7-11-17)18-19(22)21(24)27-20(18)15-4-8-16(9-5-15)23-12-2-3-13-23/h4-11,20H,2-3,12-13H2,1H3