Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl N-(phenylcarbonyl)methioninate

Catalog ID
STK119656
SMILES CSCCC(C(=O)OCC(=O)Nc1nc2c(s1)cccc2)NC(=O)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 C21H21N3O4S2 MW 443.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S2/c1-29-12-11-16(22-19(26)14-7-3-2-4-8-14)20(27)28-13-18(25)24-21-23-15-9-5-6-10-17(15)30-21/h2-10,16H,11-13H2,1H3,(H,22,26)(H,23,24,25)
InChIKey
GDEMURGCUKAEJN-UHFFFAOYSA-N
Synonyms
489452-43-9
(2(13BENZOTHIAZOL2YLAMINO)2OXOETHYL)2BENZAMIDO4METHYLSULFANYLBUTANOATE
2(13BENZOTHIAZOL2YLAMINO)2OXOETHYLN(PHENYLCARBONYL)METHIONINATE
489452439
CSCCC(C(=O)OCC(=O)NC1=NC2=CC=CC=C2S1)NC(=O)C3=CC=CC=C3
InChI=1SC21H21N3O4S2c129121116(2219(26)147324814)20(27)281318(25)242123159561017(15)3021h21016H1113H21H3(H2226)(H232425)
MFCD02175832
ZINC000002768702
ZINC000002768703

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Available files

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