Vitas-M small molecule compound
methyl (2Z)-2-(1-acetyl-2,2,7-trimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate
Catalog ID
STK042476
SMILES COC(=O)C1=C(S/C(=C/2\c3ccc(cc3N(C(C2=S)(C)C)C(=O)C)C)/S1)c1ccccc1
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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 C25H23NO3S3 MW 481.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23NO3S3/c1-14-11-12-17-18(13-14)26(15(2)27)25(3,4)22(30)19(17)24-31-20(16-9-7-6-8-10-16)21(32-24)23(28)29-5/h6-13H,1-5H3/b24-19-InChIKey
RGOSDTMWVFMBRF-CLCOLTQESA-NSynonyms
CC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)C(=S)C(N2C(=O)C)(C)C
COC(=O)C1=C(SC(=C2c3ccc(cc3N(C(C2=S)(C)C)C(=O)C)C)S1)c1ccccc1
InChI=1SC25H23NO3S3c11411121718(1314)26(15(2)27)25(34)22(30)19(17)243120(1697681016)21(3224)23(28)295h613H15H3b2419
METHYL(2Z)2(1ACETYL227TRIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
METHYL(2Z)2(1ACETYL227TRIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
METHYL2(1ACETYL227TRIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5PHENYL13DITHIOLENE4CARBOXYLATE
METHYL2(1ACETYL227TRIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
MFCD01559640
STK042476
ZINC000002181999
ZINC02181999
ZINC2181999
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.