ethyl (2E)-2-[2,2-dimethyl-3-sulfanylidene-6-(triphenylmethyl)-1H-quinolin-4-ylidene]-5-phenyl-1,3-dithiole-4-carboxylate

Systemtic Name: ethyl (2E)-2-[2,2-dimethyl-3-sulfanylidene-6-(triphenylmethyl)-1H-quinolin-4-ylidene]-5-phenyl-1,3-dithiole-4-carboxylate Openeye Name: ethyl (2E)-2-(2,2-dimethyl-3-thioxo-6-trityl-1H-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate CAS Name: (2E)-2-[2,2-dimethyl-3-sulfanylidene-6-(triphenylmethyl)-1H-quinolin-4-ylidene]-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (2E)-2-(2,2-dimethyl-3-sulfanylidene-6-trityl-1H-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate Traditional Name: (2E)-2-(2,2-dimethyl-3-thioxo-6-trityl-1H-quinolin-4-ylidene)-5-phenyl-1,3-dithiole-4-carboxylic acid ethyl ester Formula: C42H35NO2S3 MolecularWeight: 681.9278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C2C3=C(C=CC(=C3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)NC(C2=S)(C)C)S1)C7=CC=CC=C7

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\2/C3=C(C=CC(=C3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)NC(C2=S)(C)C)/S1)C7=CC=CC=C7

InChI

InChI=1S/C42H35NO2S3/c1-4-45-39(44)37-36(28-17-9-5-10-18-28)47-40(48-37)35-33-27-32(25-26-34(33)43-41(2,3)38(35)46)42(29-19-11-6-12-20-29,30-21-13-7-14-22-30)31-23-15-8-16-24-31/h5-27,43H,4H2,1-3H3/b40-35+