methyl 7-methoxy-2,2-dimethyl-4-[4-phenyl-5-(phenylcarbonyl)-1,3-dithiol-2-ylidene]-3-sulfanylidene-quinoline-1-carboxylate

Systemtic Name: methyl 7-methoxy-2,2-dimethyl-4-[4-phenyl-5-(phenylcarbonyl)-1,3-dithiol-2-ylidene]-3-sulfanylidene-quinoline-1-carboxylate Openeye Name: methyl 4-(4-benzoyl-5-phenyl-1,3-dithiol-2-ylidene)-7-methoxy-2,2-dimethyl-3-thioxo-quinoline-1-carboxylate CAS Name: 4-(4-benzoyl-5-phenyl-1,3-dithiol-2-ylidene)-7-methoxy-2,2-dimethyl-3-sulfanylidene-1-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-benzoyl-5-phenyl-1,3-dithiol-2-ylidene)-7-methoxy-2,2-dimethyl-3-sulfanylidenequinoline-1-carboxylate Traditional Name: 4-(4-benzoyl-5-phenyl-1,3-dithiol-2-ylidene)-7-methoxy-2,2-dimethyl-3-thioxo-quinoline-1-carboxylic acid methyl ester Formula: C30H25NO4S3 MolecularWeight: 559.7188

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=S)C(=C2SC(=C(S2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=C(N1C(=O)OC)C=C(C=C5)OC)C

Isomeric SMILES

CC1(C(=S)C(=C2SC(=C(S2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=C(N1C(=O)OC)C=C(C=C5)OC)C

InChI

InChI=1S/C30H25NO4S3/c1-30(2)27(36)23(21-16-15-20(34-3)17-22(21)31(30)29(33)35-4)28-37-25(19-13-9-6-10-14-19)26(38-28)24(32)18-11-7-5-8-12-18/h5-17H,1-4H3