Vitas-M small molecule compound
1-(4-chlorobenzyl)-3-(3-hydroxypropyl)-6,6-dimethyl-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Catalog ID
STK604256
SMILES OCCCn1c(=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 C21H23ClN2O4S MW 434.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN2O4S/c1-21(2)10-15-16(12-28-21)29-19-17(15)18(26)23(8-3-9-25)20(27)24(19)11-13-4-6-14(22)7-5-13/h4-7,25H,3,8-12H2,1-2H3InChIKey
AOBWDZLFYHOSEM-UHFFFAOYSA-NSynonyms
904006-02-61((4chlorophenyl)methyl)3(3hydroxypropyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidine24dione
1(4chlorobenzyl)3(3hydroxypropyl)66dimethyl1568tetrahydro2Hpyrano(4345)thieno(23d)pyrimidine24(3H)dione
1(4chlorobenzyl)3(3hydroxypropyl)66dimethyl56dihydro1Hpyrano(4345)thieno(23d)pyrimidine24(3H8H)dione
904006026
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=O)N3CC4=CC=C(C=C4)Cl)CCCO)C
InChI=1SC21H23ClN2O4Sc121(2)101516(122821)291917(15)18(26)23(83925)20(27)24(19)11134614(22)7513h4725H3812H212H3
MFCD08292557
ZINC000013609423
ZINC13609423
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