Vitas-M small molecule compound
4-(5,6-dimethyl-4-oxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidin-2-yl)phenyl 4-tert-butylbenzoate
Catalog ID
STK378488
SMILES O=C(c1ccc(cc1)C(C)(C)C)Oc1ccc(cc1)C1NC(=O)c2c(N1)sc(c2C)C
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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 C25H26N2O3S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3S/c1-14-15(2)31-23-20(14)22(28)26-21(27-23)16-8-12-19(13-9-16)30-24(29)17-6-10-18(11-7-17)25(3,4)5/h6-13,21,27H,1-5H3,(H,26,28)InChIKey
CJRJVPYPQSJNOE-UHFFFAOYSA-NSynonyms
(4(56DIMETHYL4OXO23DIHYDRO1HTHIENO(23D)PYRIMIDIN2YL)PHENYL)4TERTBUTYLBENZOATE
4(56dimethyl4oxo1234tetrahydrothieno(23d)pyrimidin2yl)phenyl4tertbutylbenzoate
4(56DIMETHYL4OXO123TRIHYDROTHIOPHENO(23D)PYRIMIDIN2YL)PHENYL4(TERTBUTYL)BENZOATE
CC1=C(SC2=C1C(=O)NC(N2)C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)C(C)(C)C)C
InChI=1SC25H26N2O3Sc11415(2)312320(14)22(28)2621(2723)1681219(13916)3024(29)1761018(11717)25(34)5h6132127H15H3(H2628)
MFCD01786931
ZINC000008843015
ZINC000016157468
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