Vitas-M small molecule compound
8-(azepan-1-ylmethyl)-3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-4H-chromen-4-one
Catalog ID
STK888549
SMILES CCc1cc2c(c(c1O)CN1CCCCCC1)occ(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 C25H26N2O3S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3S/c1-2-16-13-17-23(29)19(25-26-20-9-5-6-10-21(20)31-25)15-30-24(17)18(22(16)28)14-27-11-7-3-4-8-12-27/h5-6,9-10,13,15,28H,2-4,7-8,11-12,14H2,1H3InChIKey
GCOVSFFYWXUGEY-UHFFFAOYSA-NSynonyms
637747-29-6637747296
8(AZAPERHYDROEPINYLMETHYL)3BENZOTHIAZOL2YL6ETHYL7HYDROXYCHROMEN4ONE
8(AZEPAN1IUM1YLMETHYL)3(13BENZOTHIAZOL2YL)6ETHYL4OXOCHROMEN7OLATE
8(azepan1ylmethyl)3(13benzothiazol2yl)6ethyl7hydroxy4Hchromen4one
8(AZEPAN1YLMETHYL)3(13BENZOTHIAZOL2YL)6ETHYL7HYDROXYCHROMEN4ONE
8(AZEPAN1YLMETHYL)3(BENZO(D)THIAZOL2YL)6ETHYL7HYDROXY4HCHROMEN4ONE
CCC1=C(C(=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)C(NH+)5CCCCCC5)(O)
InChI=1SC25H26N2O3Sc1216131723(29)19(2526209561021(20)3125)153024(17)18(22(16)28)14271173481227h56910131528H2478111214H21H3
MFCD03669299
ZINC000001768869
ZINC1768869
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