Vitas-M small molecule compound

prop-2-en-1-yl (2Z)-2-(1-heptyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK798171
SMILES CCCCCCCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)c2ccc(cc2)OC)C(=O)OCC=C)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 C33H35N3O5S MW 585.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O5S/c1-5-7-8-9-12-19-35-25-14-11-10-13-24(25)27(30(35)37)29-31(38)36-28(22-15-17-23(40-4)18-16-22)26(32(39)41-20-6-2)21(3)34-33(36)42-29/h6,10-11,13-18,28H,2,5,7-9,12,19-20H2,1,3-4H3/b29-27-
InChIKey
CGPYBBCNLRBSIR-OHYPFYFLSA-N
Synonyms

CCCCCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC=C(C=C5)OC)C1=O
CCCCCCCN1c2ccccc2C(=c2sc3=NC(=C(C(n3c2=O)c2ccc(cc2)OC)C(=O)OCC=C)C)C1=O
InChI=1SC33H35N3O5Sc15789121935251411101324(25)27(30(35)37)2931(38)3628(22151723(404)181622)26(32(39)412062)21(3)3433(36)4229h61011131828H2579121920H2134H3b2927
MFCD03417575
prop2en1yl(2Z)2(1heptyl2oxo12dihydro3Hindol3ylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
prop2enyl(2Z)2(1heptyl2oxoindol3ylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000100838353
ZINC000100838354

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Available files

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