Vitas-M small molecule compound
1-(butanoylsulfanyl)-8-methoxy-4,4-dimethyl-4,5-dihydro[1,2]dithiolo[3,4-c]quinolin-2-ium
Catalog ID
STK870185
SMILES CCCC(=O)Sc1[s+]sc2c1c1cc(OC)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 C17H20NO2S3 MW 366.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20NO2S3/c1-5-6-13(19)21-16-14-11-9-10(20-4)7-8-12(11)18-17(2,3)15(14)22-23-16/h7-9,18H,5-6H2,1-4H3/q+1InChIKey
VMYBJHJRBYJWNT-UHFFFAOYSA-NSynonyms
1(butanoylsulfanyl)8methoxy44dimethyl45dihydro(12)dithiolo(34c)quinolin2ium
1(BUTYRYLSULFANYL)8METHOXY44DIMETHYL4H5H(12)DITHIOLO(34C)QUINOLIN2IUM
BUTANOYL(8METHOXY44DIMETHYL5HDITHIOLO(34C)QUINOLIN1YLIDENE)SULFANIUM
CCCC(=O)(S+)=C1C2=C(C(NC3=C2C=C(C=C3)OC)(C)C)SS1
CCCC(=O)Sc1(s+)sc2c1c1cc(OC)ccc1NC2(C)C
InChI=1SC17H20NO2S3c15613(19)21161411910(204)7812(11)1817(23)15(14)222316h7918H56H214H3q+1
ZINC000003880336
ZINC03880336
ZINC3880336
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