Vitas-M small molecule compound
[1-(4-chlorobenzyl)-6,6-dimethyl-2,4-dioxo-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(4H)-yl]acetic acid
Catalog ID
STK609741
SMILES OC(=O)Cn1c(=O)n(Cc2ccc(cc2)Cl)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 C20H19ClN2O5S MW 434.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN2O5S/c1-20(2)7-13-14(10-28-20)29-18-16(13)17(26)22(9-15(24)25)19(27)23(18)8-11-3-5-12(21)6-4-11/h3-6H,7-10H2,1-2H3,(H,24,25)InChIKey
IUBKZJXBZMPRTK-UHFFFAOYSA-NSynonyms
903859-12-1(1(4chlorobenzyl)66dimethyl24dioxo1568tetrahydro2Hpyrano(4345)thieno(23d)pyrimidin3(4H)yl)aceticacid
2(1((4chlorophenyl)methyl)66dimethyl24dioxo58dihydropyrano(23)thieno(24b)pyrimidin3yl)aceticacid
2(1(4chlorobenzyl)66dimethyl24dioxo56dihydro1Hpyrano(4345)thieno(23d)pyrimidin3(2H4H8H)yl)aceticacid
903859121
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CC4=CC=C(C=C4)Cl)CC(=O)O)C
InChI=1SC20H19ClN2O5Sc120(2)71314(102820)291816(13)17(26)22(915(24)25)19(27)23(18)8113512(21)6411h36H710H212H3(H2425)
MFCD08287880
ZINC000009409844
ZINC9409844
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