Vitas-M small molecule compound

ethyl 1-{[2-(1H-pyrrol-1-yl)-1,3-benzothiazol-6-yl]carbonyl}piperidine-3-carboxylate

Catalog ID
STK622543
SMILES CCOC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)sc(n2)n1cccc1

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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 C20H21N3O3S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S/c1-2-26-19(25)15-6-5-11-23(13-15)18(24)14-7-8-16-17(12-14)27-20(21-16)22-9-3-4-10-22/h3-4,7-10,12,15H,2,5-6,11,13H2,1H3
InChIKey
LCSIRGGXPZGIRZ-UHFFFAOYSA-N
Synonyms
929829-11-8
929829118
CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
ethyl1((2(1Hpyrrol1yl)13benzothiazol6yl)carbonyl)piperidine3carboxylate
ethyl1(2(1Hpyrrol1yl)benzo(d)thiazole6carbonyl)piperidine3carboxylate
ethyl1(2pyrrol1yl13benzothiazole6carbonyl)piperidine3carboxylate
InChI=1SC20H21N3O3Sc122619(25)15651123(1315)18(24)14781617(1214)2720(2116)229341022h347101215H2561113H21H3
MFCD09796407
ZINC000009481314
ZINC000009481318

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Available files

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