Vitas-M small molecule compound
3-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-[2-(morpholin-4-yl)ethyl]propanamide
Catalog ID
STK626227
SMILES COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)NCCN1CCOCC1
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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 C22H30N4O6 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O6/c1-30-18-12-15-11-17-21(28)25(22(29)26(17)14-16(15)13-19(18)31-2)5-3-20(27)23-4-6-24-7-9-32-10-8-24/h12-13,17H,3-11,14H2,1-2H3,(H,23,27)/t17-/m0/s1InChIKey
NVPQSGNWAQVOSQ-KRWDZBQOSA-NSynonyms
1013794-26-7(S)3(78dimethoxy13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)N(2morpholinoethyl)propanamide
1013794267
3((10aS)78dimethoxy13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)N(2morpholin4ylethyl)propanamide
3((10aS)78dimethoxy13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)N(2(morpholin4yl)ethyl)propanamide
COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=O)CCC(=O)NCCN4CCOCC4)OC
COc1cc2CN3C(=O)N(C(=O)(C@@H)3Cc2cc1OC)CCC(=O)NCCN1CCOCC1
InChI=1SC22H30N4O6c130181215111721(28)25(22(29)26(17)1416(15)1319(18)312)5320(27)234624793210824h121317H31114H212H3(H2327)t17m0s1
MFCD09857304
ZINC000013729750
ZINC13729750
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