Vitas-M small molecule compound

3-cyclohexyl-1-(8-ethoxy-4,4-dimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one

Catalog ID
STK082432
SMILES CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CCC1CCCCC1)(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 C23H29NO2S3 MW 447.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO2S3/c1-4-26-16-11-12-18-17(14-16)20-21(28-29-22(20)27)23(2,3)24(18)19(25)13-10-15-8-6-5-7-9-15/h11-12,14-15H,4-10,13H2,1-3H3
InChIKey
XYUWNYSMNORFCH-UHFFFAOYSA-N
Synonyms
351192-03-5
351192035
3CYCLOHEXYL1(8ETHOXY44DIMETHYL1SULFANYLIDENEDITHIOLO(34C)QUINOLIN5YL)PROPAN1ONE
3CYCLOHEXYL1(8ETHOXY44DIMETHYL1THIOXO(45DIHYDRO12DITHIOLENO(54C)QUINOLIN5YL))PROPAN1ONE
3CYCLOHEXYL1(8ETHOXY44DIMETHYL1THIOXO14DIHYDRO5H(12)DITHIOLO(34C)QUINOLIN5YL)PROPAN1ONE
3CYCLOHEXYL1(8ETHOXY44DIMETHYL1THIOXO1H(12)DITHIOLO(34C)QUINOLIN5(4H)YL)PROPAN1ONE
5(3CYCLOHEXYLPROPANOYL)8ETHOXY44DIMETHYL45DIHYDRO1H(12)DITHIOLO(34C)QUINOLINE1THIONE
CCOC1=CC2=C(C=C1)N(C(C3=C2C(=S)SS3)(C)C)C(=O)CCC4CCCCC4
CCOc1ccc2c(c1)c1c(=S)ssc1C(N2C(=O)CCC1CCCCC1)(C)C
InChI=1SC23H29NO2S3c14261611121817(1416)2021(282922(20)27)23(23)24(18)19(25)1310158657915h11121415H41013H213H3
MFCD01562917
STK082432
ZINC000002063143
ZINC02063143
ZINC2063143

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Available files

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