Vitas-M small molecule compound
diethyl 2-[8-ethoxy-2,2-dimethyl-1-(phenylcarbonyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK016424
SMILES CCOc1cccc2c1N(C(=O)c1ccccc1)C(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OCC)C(=O)OCC)(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 C29H29NO6S3 MW 583.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO6S3/c1-6-34-19-16-12-15-18-20(28-38-22(26(32)35-7-2)23(39-28)27(33)36-8-3)24(37)29(4,5)30(21(18)19)25(31)17-13-10-9-11-14-17/h9-16H,6-8H2,1-5H3InChIKey
KWMNKTKJRSGNRA-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC2=C1N(C(C(=S)C2=C3SC(=C(S3)C(=O)OCC)C(=O)OCC)(C)C)C(=O)C4=CC=CC=C4
CCOc1cccc2c1N(C(=O)c1ccccc1)C(C(=S)C2=C1SC(=C(S1)C(=O)OCC)C(=O)OCC)(C)C
DIETHYL2(1BENZOYL8ETHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(1BENZOYL8ETHOXY22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(1benzoyl8ethoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIETHYL2(8ETHOXY22DIMETHYL1(PHENYLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
ETHYL2(8ETHOXY22DIMETHYL1(PHENYLCARBONYL)3THIOXO(412DIHYDROQUINOLYLIDENE))5(ETHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
InChI=1SC29H29NO6S3c1634191612151820(283822(26(32)3572)23(3928)27(33)3683)24(37)29(45)30(21(18)19)25(31)1713109111417h916H68H215H3
MFCD01953071
STK016424
ZINC000008432154
ZINC08432154
ZINC8432154
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