naphthalen-1-ylmethyl 4,4,7-trimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinoline-5-carboxylate

Systemtic Name: naphthalen-1-ylmethyl 4,4,7-trimethyl-1-sulfanylidene-[1,2]dithiolo[3,4-c]quinoline-5-carboxylate Openeye Name: 1-naphthylmethyl 4,4,7-trimethyl-1-thioxo-dithiolo[3,4-c]quinoline-5-carboxylate CAS Name: 4,4,7-trimethyl-1-sulfanylidene-5-dithiolo[3,4-c]quinolinecarboxylic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4,4,7-trimethyl-1-sulfanylidenedithiolo[3,4-c]quinoline-5-carboxylate Traditional Name: 4,4,7-trimethyl-1-thioxo-dithiolo[3,4-c]quinoline-5-carboxylic acid 1-naphthylmethyl ester Formula: C25H21NO2S3 MolecularWeight: 463.63474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C3=C(C(N2C(=O)OCC4=CC=CC5=CC=CC=C54)(C)C)SSC3=S

Isomeric SMILES

CC1=CC2=C(C=C1)C3=C(C(N2C(=O)OCC4=CC=CC5=CC=CC=C54)(C)C)SSC3=S

InChI

InChI=1S/C25H21NO2S3/c1-15-11-12-19-20(13-15)26(25(2,3)22-21(19)23(29)31-30-22)24(27)28-14-17-9-6-8-16-7-4-5-10-18(16)17/h4-13H,14H2,1-3H3