Vitas-M small molecule compound
2-[(3-bromophenyl)amino]-9,10-dimethoxy-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-4-one
Catalog ID
STL349539
SMILES COc1cc2c(cc1OC)CCn1c2cc(Nc2cccc(c2)Br)nc1=O
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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 C20H18BrN3O3 MW 428.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN3O3/c1-26-17-8-12-6-7-24-16(15(12)10-18(17)27-2)11-19(23-20(24)25)22-14-5-3-4-13(21)9-14/h3-5,8-11H,6-7H2,1-2H3,(H,22,23,25)InChIKey
AOIIXQQUYRCPFW-UHFFFAOYSA-NSynonyms
896836-97-82((3bromophenyl)amino)910dimethoxy67dihydro4Hpyrimido(61a)isoquinolin4one
2(3BROMOANILINO)910DIMETHOXY67DIHYDROPYRIMIDO(61A)ISOQUINOLIN4ONE
896836978
COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NC4=CC(=CC=C4)Br)OC
InChI=1SC20H18BrN3O3c12617812672416(15(12)1018(17)272)1119(2320(24)25)221453413(21)914h35811H67H212H3(H222325)
MFCD06600171
ZINC000002223376
ZINC02223376
ZINC2223376
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