AC1LYR85 structure

AC1LYR85

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

Also Known As: Oprea1_312515|Oprea1_723728|BAS 00721863|AG-690/11835047|1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-naphthalen-1-ylethanone|4,4-dimethyl-5-(1-naphthylacetyl)-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinoline-1-thione|1-(4,4-dimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5-yl))-2-na phthylethan-1-one|1-(4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(naphthalen-1-yl)ethanone|1-(4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)-2-(naphthalen-1-yl)ethanone

CAS: 331973-25-2
Molecular Formula C24H19NOS3
Molecular Weight 433.06287 g/mol
LogP 7.18369
Topological Polar Surface Area 20.31 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 433.06287
Monoisotopic Mass 433.06287
Heavy Atoms 29
Complexity 1309.7124

Chemical Identifiers

CAS Number 331973-25-2
SMILES CC1(C2=C(C3=CC=CC=C3N1C(=O)CC4=CC=CC5=CC=CC=C54)C(=S)SS2)C

Product Overview

AC1LYR85 (CAS 331973-25-2), with molecular formula C24H19NOS3 and molecular weight 433.06287 g/mol. IUPAC: 1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-naphthalen-1-ylethanone.

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