Vitas-M small molecule compound
dimethyl 2-{2,2-dimethyl-1-[(4-methylphenyl)carbonyl]-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STL361172
SMILES COC(=O)C1=C(S/C(=C\2/c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2)C)/S1)C(=O)OC
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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 C26H23NO5S3 MW 525.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5S3/c1-14-10-12-15(13-11-14)22(28)27-17-9-7-6-8-16(17)18(21(33)26(27,2)3)25-34-19(23(29)31-4)20(35-25)24(30)32-5/h6-13H,1-5H3InChIKey
KJFYZVOFLZRKTA-UHFFFAOYSA-NSynonyms
300717-06-0300717060
CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C4SC(=C(S4)C(=O)OC)C(=O)OC)C(=S)C2(C)C
COC(=O)C1=C(SC(=C2c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccc(cc2)C)S1)C(=O)OC
dimethyl2(22dimethyl1((4methylphenyl)carbonyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(22DIMETHYL1(4METHYLBENZOYL)3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(22DIMETHYL1(4METHYLBENZOYL)3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(22dimethyl1(4methylbenzoyl)3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC26H23NO5S3c114101215(131114)22(28)2717976816(17)18(21(33)26(272)3)253419(23(29)314)20(3525)24(30)325h613H15H3
METHYL2(22DIMETHYL1((4METHYLPHENYL)CARBONYL)3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD00630834
ZINC000008398222
ZINC08398222
ZINC8398222
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