Vitas-M small molecule compound

2-amino-3-(1,3-benzothiazol-2-yl)-7-hydroxy-8-[(2-methylpiperidin-1-yl)methyl]-4H-chromen-4-one

Catalog ID
STK548968
SMILES CC1CCCCN1Cc1c(O)ccc2c1oc(N)c(c2=O)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 C23H23N3O3S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O3S/c1-13-6-4-5-11-26(13)12-15-17(27)10-9-14-20(28)19(22(24)29-21(14)15)23-25-16-7-2-3-8-18(16)30-23/h2-3,7-10,13,27H,4-6,11-12,24H2,1H3
InChIKey
CHUMOEDFCLOHDH-UHFFFAOYSA-N
Synonyms
610759-76-7
2AMINO3(13BENZOTHIAZOL2YL)7HYDROXY8((2METHYL1PIPERIDINYL)METHYL)1BENZOPYRAN4ONE
2amino3(13benzothiazol2yl)7hydroxy8((2methylpiperidin1yl)methyl)4Hchromen4one
2AMINO3(13BENZOTHIAZOL2YL)7HYDROXY8((2METHYLPIPERIDIN1YL)METHYL)CHROMEN4ONE
2AMINO3(13BENZOTHIAZOL2YL)7HYDROXY8((2METHYLPIPERIDINO)METHYL)CHROMONE
2amino3(13benzothiazol2yl)8((2methylpiperidin1ium1yl)methyl)4oxochromen7olate
2amino3(benzo(d)thiazol2yl)7hydroxy8((2methylpiperidin1yl)methyl)4Hchromen4one
2AMINO3BENZOTHIAZOL2YL7HYDROXY8(2METHYLPIPERIDIN1YLMETHYL)CHROMEN4ONE
2AZANYL3(13BENZOTHIAZOL2YL)8((2METHYLPIPERIDIN1YL)METHYL)7OXIDANYLCHROMEN4ONE
610759767
CC1CCCC(NH+)1CC2=C(C=CC3=C2OC(=C(C3=O)C4=NC5=CC=CC=C5S4)N)(O)
InChI=1SC23H23N3O3Sc1136451126(13)121517(27)1091420(28)19(22(24)2921(14)15)232516723818(16)3023h237101327H46111224H21H3
MFCD03670872
ZINC000008691788
ZINC000013496648

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Available files

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