Vitas-M small molecule compound

4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-N-(6-methylpyridin-2-yl)-4-oxobutanamide

Catalog ID
STK941499
SMILES O=C(Nc1cccc(n1)C)CCC(=O)N1CCN(CC1)c1nsc2c1cccc2

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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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-15-5-4-8-18(22-15)23-19(27)9-10-20(28)25-11-13-26(14-12-25)21-16-6-2-3-7-17(16)29-24-21/h2-8H,9-14H2,1H3,(H,22,23,27)
InChIKey
VRCCCCGMGGSDHV-UHFFFAOYSA-N
Synonyms
1219579-07-3
1219579073
4(4(12benzothiazol3yl)piperazin1yl)N(6methylpyridin2yl)4oxobutanamide
4(4(benzo(d)isothiazol3yl)piperazin1yl)N(6methylpyridin2yl)4oxobutanamide
CC1=NC(=CC=C1)NC(=O)CCC(=O)N2CCN(CC2)C3=NSC4=CC=CC=C43
InChI=1SC21H23N5O2Sc11554818(2215)2319(27)91020(28)25111326(141225)2116623717(16)292421h28H914H21H3(H222327)
MFCD16625933
ZINC000040285631
ZINC40285631

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.