2-(3-chloranyl-4-methyl-phenyl)-3-(2-hydroxyphenyl)sulfanyl-5,6-dimethoxy-3H-isoindol-1-one

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-3-(2-hydroxyphenyl)sulfanyl-5,6-dimethoxy-3H-isoindol-1-one Openeye Name: 2-(3-chloro-4-methyl-phenyl)-3-(2-hydroxyphenyl)sulfanyl-5,6-dimethoxy-isoindolin-1-one CAS Name: 2-(3-chloro-4-methylphenyl)-3-[(2-hydroxyphenyl)thio]-5,6-dimethoxy-3H-isoindol-1-one IUPAC Name: 2-(3-chloro-4-methylphenyl)-3-(2-hydroxyphenyl)sulfanyl-5,6-dimethoxy-3H-isoindol-1-one Traditional Name: 2-(3-chloro-4-methyl-phenyl)-3-[(2-hydroxyphenyl)thio]-5,6-dimethoxy-isoindolin-1-one Formula: C23H20ClNO4S MolecularWeight: 441.9272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(C3=CC(=C(C=C3C2=O)OC)OC)SC4=CC=CC=C4O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(C3=CC(=C(C=C3C2=O)OC)OC)SC4=CC=CC=C4O)Cl

InChI

InChI=1S/C23H20ClNO4S/c1-13-8-9-14(10-17(13)24)25-22(27)15-11-19(28-2)20(29-3)12-16(15)23(25)30-21-7-5-4-6-18(21)26/h4-12,23,26H,1-3H3