Vitas-M small molecule compound
1,3-dimethyl-5-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)sulfonyl]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STK585136
SMILES O=c1n(C)cc(c(=O)n1C)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1
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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 C19H23N3O6S MW 421.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O6S/c1-12-14-10-16-15(27-7-4-8-28-16)9-13(14)5-6-22(12)29(25,26)17-11-20(2)19(24)21(3)18(17)23/h9-12H,4-8H2,1-3H3InChIKey
BANARCHZXBQGTH-UHFFFAOYSA-NSynonyms
898913-09-213dimethyl5((7methyl2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)sulfonyl)pyrimidine24dione
13dimethyl5((7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)sulfonyl)pyrimidine24(1H3H)dione
898913092
CC1C2=CC3=C(C=C2CCN1S(=O)(=O)C4=CN(C(=O)N(C4=O)C)C)OCCCO3
InChI=1SC19H23N3O6Sc11214101615(277482816)913(14)5622(12)29(2526)171120(2)19(24)21(3)18(17)23h912H48H213H3
MFCD07639207
ZINC000005425927
ZINC000005425936
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