Vitas-M small molecule compound
4,4,8-trimethyl-1-[(2-methylpropanoyl)sulfanyl]-4,5-dihydro[1,2]dithiolo[3,4-c]quinolin-2-ium
Catalog ID
STL043192
SMILES O=C(C(C)C)Sc1[s+]sc2c1c1cc(C)ccc1NC2(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H20NOS3 MW 350.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20NOS3/c1-9(2)15(19)20-16-13-11-8-10(3)6-7-12(11)18-17(4,5)14(13)21-22-16/h6-9,18H,1-5H3/q+1InChIKey
NZLNNEQHIWWIMV-UHFFFAOYSA-NSynonyms
1(isobutyrylthio)448trimethyl45dihydro(12)dithiolo(34c)quinolin2iumchloride
2METHYL1(448TRIMETHYL(45DIHYDRO12DITHIOLO(34C)QUINOLINYLTHIO))PROPAN1ONE
2METHYLPROPANOYL(448TRIMETHYL5HDITHIOLO(34C)QUINOLIN1YLIDENE)SULFANIUM
448trimethyl1((2methylpropanoyl)sulfanyl)45dihydro(12)dithiolo(34c)quinolin2ium
CC1=CC2=C(C=C1)NC(C3=C2C(=(S+)C(=O)C(C)C)SS3)(C)C
InChI=1SC17H20NOS3c19(2)15(19)20161311810(3)6712(11)1817(45)14(13)212216h6918H15H3q+1
O=C(C(C)C)Sc1(s+)sc2c1c1cc(C)ccc1NC2(C)C
O=C(C(C)C)Sc1(s+)sc2c1c1cc(C)ccc1NC2(C)C(Cl)
ZINC000003878843
ZINC03878843
ZINC3878843
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