1-(6-ethoxy-4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenoxy-ethanone

Systemtic Name: 1-(6-ethoxy-4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenoxy-ethanone Openeye Name: 1-(6-ethoxy-4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-2-phenoxy-ethanone CAS Name: 1-(6-ethoxy-4,4-dimethyl-1-sulfanylidene-5-dithiolo[3,4-c]quinolinyl)-2-phenoxyethanone IUPAC Name: 1-(6-ethoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-phenoxyethanone Traditional Name: 1-(6-ethoxy-4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-2-phenoxy-ethanone Formula: C22H21NO3S3 MolecularWeight: 443.60204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N(C(C3=C2C(=S)SS3)(C)C)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC2=C1N(C(C3=C2C(=S)SS3)(C)C)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C22H21NO3S3/c1-4-25-16-12-8-11-15-18-20(28-29-21(18)27)22(2,3)23(19(15)16)17(24)13-26-14-9-6-5-7-10-14/h5-12H,4,13H2,1-3H3