Vitas-M small molecule compound
methyl (2Z)-5-phenyl-2-[2,2,6-trimethyl-1-(phenylcarbonyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4-carboxylate
Catalog ID
STK018523
SMILES COC(=O)C1=C(S/C(=C/2\c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2ccccc2)/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 C30H25NO3S3 MW 543.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25NO3S3/c1-18-15-16-22-21(17-18)23(26(35)30(2,3)31(22)27(32)20-13-9-6-10-14-20)29-36-24(19-11-7-5-8-12-19)25(37-29)28(33)34-4/h5-17H,1-4H3/b29-23-InChIKey
FZOTYIBLBYCXPQ-FAJYDZGRSA-NSynonyms
332074-28-9(Z)methyl2(1benzoyl226trimethyl3thioxo23dihydroquinolin4(1H)ylidene)5phenyl13dithiole4carboxylate
332074289
CC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C4=CC=CC=C4)(C)C)C(=O)C5=CC=CC=C5
COC(=O)C1=C(SC(=C2c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2ccccc2)S1)c1ccccc1
InChI=1SC30H25NO3S3c11815162221(1718)23(26(35)30(23)31(22)27(32)201396101420)293624(19117581219)25(3729)28(33)344h517H14H3b2923
METHYL(2Z)2(1BENZOYL226TRIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
METHYL(2Z)5PHENYL2(226TRIMETHYL1(PHENYLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE4CARBOXYLATE
METHYL2(1BENZOYL226TRIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)5PHENYL13DITHIOLE4CARBOXYLATE
MFCD01563835
STK018523
ZINC000002063018
ZINC02063018
ZINC2063018
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