AC1LDKTV

1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Also Known As: ChemDiv1_005495|Oprea1_402155|Oprea1_870358|HMS602J17|BAS 01095171|SR-01000450069-1|1-(4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone|1-(4,4-dimethyl-1-sulfanylidenedithiolo[3,4-c]quinolin-5-yl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanone|1-(4,4-dimethyl-1-thioxo(4,5-dihydro-1,2-dithioleno[5,4-c]quinolin-5-yl))-2-(4 -methyl(1,2,4-triazol-3-ylthio))ethan-1-one|1-(4,4-Dimethyl-1-thioxo-1,4-dihydro-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-ethanone|1-(4,4-dimethyl-1-thioxo-1H-[1,2]dithiolo[3,4-c]quinolin-5(4H)-yl)-2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)ethanone|1-{4,4-DIMETHYL-1-SULFANYLIDENE-1H,4H,5H-[1,2]DITHIOLO[3,4-C]QUINOLIN-5-YL}-2-[(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ETHAN-1-ONE

Molecular Formula	C17H16N4OS4
Molecular Weight	420.0207 g/mol
LogP	2.4
Topological Polar Surface Area	159.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	3
Exact Mass	420.0207
Monoisotopic Mass	420.0207
Heavy Atoms	26
Complexity	653.0

Chemical Identifiers

CAS Number	336176-76-2
SMILES	CC1(C2=C(C3=CC=CC=C3N1C(=O)CSC4=NN=CN4C)C(=S)SS2)C
InChIKey	AVLSKNFHDVLHHI-UHFFFAOYSA-N