Vitas-M small molecule compound
methyl {6,6-dimethyl-2,4-dioxo-1-[2-(pyrrolidin-1-yl)ethyl]-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl}acetate
Catalog ID
STK613380
SMILES COC(=O)Cn1c(=O)n(CCN2CCCC2)c2c(c1=O)c1CC(C)(C)OCc1s2
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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 C20H27N3O5S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O5S/c1-20(2)10-13-14(12-28-20)29-18-16(13)17(25)23(11-15(24)27-3)19(26)22(18)9-8-21-6-4-5-7-21/h4-12H2,1-3H3InChIKey
XVZMMSYDTINHHY-UHFFFAOYSA-NSynonyms
903191-64-0903191640
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CCN4CCCC4)CC(=O)OC)C
InChI=1SC20H27N3O5Sc120(2)101314(122820)291816(13)17(25)23(1115(24)273)19(26)22(18)9821645721h412H213H3
methyl(66dimethyl24dioxo1(2(pyrrolidin1yl)ethyl)1568tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin3(4H)yl)acetate
methyl2(66dimethyl24dioxo1(2(pyrrolidin1yl)ethyl)56dihydro1Hpyrano(4345)thieno(23d)pyrimidin3(2H4H8H)yl)acetate
methyl2(66dimethyl24dioxo1(2pyrrolidin1ylethyl)58dihydropyrano(23)thieno(24b)pyrimidin3yl)acetate
MFCD08290449
ZINC000006759339
ZINC6759339
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