Vitas-M small molecule compound

benzyl (2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK703200
SMILES CCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)c2cccs2)C(=O)OCc2ccccc2)C)/C1=O

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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 C29H23N3O4S2 MW 541.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O4S2/c1-3-31-20-13-8-7-12-19(20)23(26(31)33)25-27(34)32-24(21-14-9-15-37-21)22(17(2)30-29(32)38-25)28(35)36-16-18-10-5-4-6-11-18/h4-15,24H,3,16H2,1-2H3/b25-23-
InChIKey
ZCXYXKASNCJPGG-BZZOAKBMSA-N
Synonyms
608120-01-0
(Z)benzyl2(1ethyl2oxoindolin3ylidene)7methyl3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
608120010
benzyl(2Z)2(1ethyl2oxo12dihydro3Hindol3ylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
benzyl(2Z)2(1ethyl2oxoindol3ylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
CCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC5=CC=CC=C5)C6=CC=CS6)C1=O
CCN1c2ccccc2C(=c2sc3=NC(=C(C(n3c2=O)c2cccs2)C(=O)OCc2ccccc2)C)C1=O
InChI=1SC29H23N3O4S2c13312013871219(20)23(26(31)33)2527(34)3224(21149153721)22(17(2)3029(32)3825)28(35)361618105461118h41524H316H212H3b2523
MFCD03667872
ZINC000100857938
ZINC000100857939

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Available files

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