2-[2-[2-(4-ethoxyphenyl)-4,4-dimethyl-1-sulfanylidene-[1,2]thiazolo[5,4-c]quinolin-5-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(4-ethoxyphenyl)-4,4-dimethyl-1-sulfanylidene-[1,2]thiazolo[5,4-c]quinolin-5-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(4-ethoxyphenyl)-4,4-dimethyl-1-thioxo-isothiazolo[5,4-c]quinolin-5-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(4-ethoxyphenyl)-4,4-dimethyl-1-sulfanylidene-5-isothiazolo[5,4-c]quinolinyl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(4-ethoxyphenyl)-4,4-dimethyl-1-sulfanylidene-[1,2]thiazolo[5,4-c]quinolin-5-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-(4,4-dimethyl-2-p-phenetyl-1-thioxo-isothiazolo[5,4-c]quinolin-5-yl)-2-keto-ethyl]isoindoline-1,3-quinone Formula: C30H25N3O4S2 MolecularWeight: 555.6672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=S)C3=C(S2)C(N(C4=CC=CC=C43)C(=O)CN5C(=O)C6=CC=CC=C6C5=O)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=S)C3=C(S2)C(N(C4=CC=CC=C43)C(=O)CN5C(=O)C6=CC=CC=C6C5=O)(C)C

InChI

InChI=1S/C30H25N3O4S2/c1-4-37-19-15-13-18(14-16-19)33-29(38)25-22-11-7-8-12-23(22)32(30(2,3)26(25)39-33)24(34)17-31-27(35)20-9-5-6-10-21(20)28(31)36/h5-16H,4,17H2,1-3H3