1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-3-phenyl-propan-1-one

Systemtic Name: 1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinolin-5-yl)-3-phenyl-propan-1-one Openeye Name: 1-(8-methoxy-4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-3-phenyl-propan-1-one CAS Name: 1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-5-dithiolo[3,4-c]quinolinyl)-3-phenyl-1-propanone IUPAC Name: 1-(8-methoxy-4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-3-phenylpropan-1-one Traditional Name: 1-(8-methoxy-4,4-dimethyl-1-thioxo-dithiolo[3,4-c]quinolin-5-yl)-3-phenyl-propan-1-one Formula: C22H21NO2S3 MolecularWeight: 427.60264

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C3=C(N1C(=O)CCC4=CC=CC=C4)C=CC(=C3)OC)C(=S)SS2)C

Isomeric SMILES

CC1(C2=C(C3=C(N1C(=O)CCC4=CC=CC=C4)C=CC(=C3)OC)C(=S)SS2)C

InChI

InChI=1S/C22H21NO2S3/c1-22(2)20-19(21(26)28-27-20)16-13-15(25-3)10-11-17(16)23(22)18(24)12-9-14-7-5-4-6-8-14/h4-8,10-11,13H,9,12H2,1-3H3