Vitas-M small molecule compound

2-{1-[3-(3-nitrophenoxy)propyl]piperidin-4-yl}-1,3-benzothiazole

Catalog ID
STK621370
SMILES [O-][N+](=O)c1cccc(c1)OCCCN1CCC(CC1)c1nc2c(s1)cccc2

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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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c25-24(26)17-5-3-6-18(15-17)27-14-4-11-23-12-9-16(10-13-23)21-22-19-7-1-2-8-20(19)28-21/h1-3,5-8,15-16H,4,9-14H2
InChIKey
SEUYIZOPYYDUJC-UHFFFAOYSA-N
Synonyms
929963-42-8
(O)(N+)(=O)c1cccc(c1)OCCCN1CCC(CC1)c1nc2c(s1)cccc2
2(1(3(3nitrophenoxy)propyl)piperidin4yl)13benzothiazole
2(1(3(3nitrophenoxy)propyl)piperidin4yl)benzo(d)thiazole
929963428
C1CN(CCC1C2=NC3=CC=CC=C3S2)CCCOC4=CC=CC(=C4)(N+)(=O)(O)
InChI=1SC21H23N3O3Sc2524(26)1753618(1517)27144112312916(101323)212219712820(19)2821h13581516H4914H2
MFCD09795039
ZINC000009052077
ZINC9052077

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Available files

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