Vitas-M small molecule compound
9-[3-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-2-hydroxypropyl]-2-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
Catalog ID
STK927574
SMILES OC(CN1C(=O)c2c(S1(=O)=O)cccc2)Cn1c2ccccc2c2c1C(=O)N(C)CC2
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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 C22H21N3O5S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S/c1-23-11-10-16-15-6-2-4-8-18(15)24(20(16)22(23)28)12-14(26)13-25-21(27)17-7-3-5-9-19(17)31(25,29)30/h2-9,14,26H,10-13H2,1H3InChIKey
JGQUYGWGZVKDTB-UHFFFAOYSA-NSynonyms
796879-44-22(2hydroxy3(2methyl1oxo34dihydro1Hpyrido(34b)indol9(2H)yl)propyl)benzo(d)isothiazol3(2H)one11dioxide
2(2HYDROXY3(2METHYL1OXO34DIHYDROPYRIDO(34B)INDOL9YL)PROPYL)11DIOXO12BENZOTHIAZOL3ONE
796879442
9(3(11dioxido3oxo12benzothiazol2(3H)yl)2hydroxypropyl)2methyl2349tetrahydro1Hbetacarbolin1one
CN1CCC2=C(C1=O)N(C3=CC=CC=C23)CC(CN4C(=O)C5=CC=CC=C5S4(=O)=O)O
InChI=1SC22H21N3O5Sc12311101615624818(15)24(20(16)22(23)28)1214(26)132521(27)17735919(17)31(2529)30h291426H1013H21H3
MFCD03669893
ZINC000002201107
ZINC000002201108
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