Vitas-M small molecule compound
3-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-2-oxoethyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL232921
SMILES COc1ccc2c(c1C)oc(=O)c(c2C)CC(=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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-15-17-8-9-20(31-3)16(2)23(17)32-25(30)19(15)14-22(29)27-10-12-28(13-11-27)24-18-6-4-5-7-21(18)33-26-24/h4-9H,10-14H2,1-3H3InChIKey
MPXVVBNYEXSDCK-UHFFFAOYSA-NSynonyms
921041-84-13(2(4(12benzothiazol3yl)piperazin1yl)2oxoethyl)7methoxy48dimethyl2Hchromen2one
3(2(4(12benzothiazol3yl)piperazin1yl)2oxoethyl)7methoxy48dimethylchromen2one
3(2(4(benzo(d)isothiazol3yl)piperazin1yl)2oxoethyl)7methoxy48dimethyl2Hchromen2one
921041841
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CC(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54
InChI=1SC25H25N3O4Sc115178920(313)16(2)23(17)3225(30)19(15)1422(29)27101228(131127)2418645721(18)332624h49H1014H213H3
MFCD08748412
ZINC000009341054
ZINC09341054
ZINC9341054
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