ChemDiv1_022649 structure

ChemDiv1_022649

ethyl 2-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoacetate

Also Known As: ChemDiv1_022649|DivK1c_003913|HMS651F11|CDS1_002873|ethyl (4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(oxo)acetate|SR-01000450102-1|ethyl 2-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoacetate|ethyl 2-(4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)-2-oxoacetate|Ethyl (4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(oxo)acetate|ethyl 2-(4,4-dimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5-yl) )-2-oxoacetate|ETHYL 2-{4,4-DIMETHYL-1-SULFANYLIDENE-[1,2]DITHIOLO[3,4-C]QUINOLIN-5-YL}-2-OXOACETATE|ETHYL 2-{4,4-DIMETHYL-1-SULFANYLIDENE-1H,4H,5H-[1,2]DITHIOLO[3,4-C]QUINOLIN-5-YL}-2-OXOACETATE

CAS: 4531-91-3
Molecular Formula C16H15NO3S3
Molecular Weight 365.0214 g/mol
LogP 4.35089
Topological Polar Surface Area 46.61 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 365.0214
Monoisotopic Mass 365.0214
Heavy Atoms 23
Complexity 850.2505

Chemical Identifiers

CAS Number 4531-91-3
SMILES CCOC(=O)C(=O)N1C2=CC=CC=C2C3=C(C1(C)C)SSC3=S

Product Overview

ChemDiv1_022649 (CAS 4531-91-3), with molecular formula C16H15NO3S3 and molecular weight 365.0214 g/mol. IUPAC: ethyl 2-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-oxoacetate.

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