Vitas-M small molecule compound
6-amino-1,3-dimethyl-5-(5,6,10,11-tetrahydro-9H-[1,4]dioxepino[2,3-g]pyrrolo[2,1-a]isoquinolin-2-yl)pyrimidine-2,4(1H,3H)-dione
Catalog ID
STK593167
SMILES Nc1c(c2cc3n(c2)CCc2c3cc3OCCCOc3c2)c(=O)n(c(=O)n1C)C
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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 C21H22N4O4 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O4/c1-23-19(22)18(20(26)24(2)21(23)27)13-8-15-14-10-17-16(28-6-3-7-29-17)9-12(14)4-5-25(15)11-13/h8-11H,3-7,22H2,1-2H3InChIKey
FGQOFPRXTHMDAC-UHFFFAOYSA-NSynonyms
898922-06-06amino13dimethyl5(561011tetrahydro9H(14)dioxepino(23g)pyrrolo(21a)isoquinolin2yl)pyrimidine24(1H3H)dione
6amino13dimethyl5(691011tetrahydro5H(14)dioxepino(23g)pyrrolo(21a)isoquinolin2yl)pyrimidine24(1H3H)dione
898922060
CN1C(=C(C(=O)N(C1=O)C)C2=CN3CCC4=CC5=C(C=C4C3=C2)OCCCO5)N
InChI=1SC21H22N4O4c12319(22)18(20(26)24(2)21(23)27)1381514101716(286372917)912(14)4525(15)1113h811H3722H212H3
MFCD07638326
ZINC000005354512
ZINC05354512
ZINC5354512
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