3-(1,2-benzothiazol-6-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one

Systemtic Name: 3-(1,2-benzothiazol-6-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Openeye Name: 3-(1,2-benzothiazol-6-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 3-(1,2-benzothiazol-6-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 3-(1,2-benzothiazol-6-yl)-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 3-(1,2-benzothiazol-6-yl)-4-(4-mesylphenyl)-5,5-dimethyl-furan-2-one Formula: C20H17NO4S2 MolecularWeight: 399.48328

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)C2=CC3=C(C=C2)C=NS3)C4=CC=C(C=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)C2=CC3=C(C=C2)C=NS3)C4=CC=C(C=C4)S(=O)(=O)C)C

InChI

InChI=1S/C20H17NO4S2/c1-20(2)18(12-6-8-15(9-7-12)27(3,23)24)17(19(22)25-20)13-4-5-14-11-21-26-16(14)10-13/h4-11H,1-3H3