Vitas-M small molecule compound
ethyl (2Z)-2-(1-butanoyl-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-5-phenyl-1,3-dithiole-4-carboxylate
Catalog ID
STK395124
SMILES CCCC(=O)N1c2ccccc2/C(=C/2\SC(=C(S2)C(=O)OCC)c2ccccc2)/C(=S)C1(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 C27H27NO3S3 MW 509.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO3S3/c1-5-12-20(29)28-19-16-11-10-15-18(19)21(24(32)27(28,3)4)26-33-22(17-13-8-7-9-14-17)23(34-26)25(30)31-6-2/h7-11,13-16H,5-6,12H2,1-4H3/b26-21-InChIKey
OQUFEZWXAWKYMV-QLYXXIJNSA-NSynonyms
331973-72-9(Z)ethyl2(1butyryl22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)5phenyl13dithiole4carboxylate
331973729
CCCC(=O)N1C2=CC=CC=C2C(=C3SC(=C(S3)C(=O)OCC)C4=CC=CC=C4)C(=S)C1(C)C
CCCC(=O)N1c2ccccc2C(=C2SC(=C(S2)C(=O)OCC)c2ccccc2)C(=S)C1(C)C
ETHYL(2Z)2(1BUTANOYL22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
ethyl(2Z)2(1butanoyl22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)5phenyl13dithiole4carboxylate
ETHYL2(1BUTANOYL22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5PHENYL13DITHIOLENE4CARBOXYLATE
ETHYL2(1BUTYRYL22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
InChI=1SC27H27NO3S3c151220(29)28191611101518(19)21(24(32)27(283)4)263322(17138791417)23(3426)25(30)3162h7111316H5612H214H3b2621
MFCD01138015
ZINC000002059468
ZINC02059468
ZINC2059468
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