Vitas-M small molecule compound

2-(3-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-ol

Catalog ID
STK603291
SMILES COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)c1nc(O)c2c(n1)sc1c2CCC1

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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 C27H27ClN2O3S MW 495.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O3S/c1-14(2)19-12-20(28)15(3)10-22(19)33-13-17-11-16(8-9-21(17)32-4)25-29-26(31)24-18-6-5-7-23(18)34-27(24)30-25/h8-12,14H,5-7,13H2,1-4H3,(H,29,30,31)
InChIKey
HXTPOVRFAXIFMN-UHFFFAOYSA-N
Synonyms
371949-57-4
2(3((4chloro5methyl2(propan2yl)phenoxy)methyl)4methoxyphenyl)67dihydro5Hcyclopenta(45)thieno(23d)pyrimidin4ol
3(3((4chloro5methyl2propan2ylphenoxy)methyl)4methoxyphenyl)2678tetrahydrocyclopenta(23)thieno(24b)pyrimidin1one
371949574
CC1=CC(=C(C=C1Cl)C(C)C)OCC2=C(C=CC(=C2)C3=NC4=C(C5=C(S4)CCC5)C(=O)N3)OC
InChI=1SC27H27ClN2O3Sc114(2)191220(28)15(3)1022(19)3313171116(8921(17)324)252926(31)241865723(18)3427(24)3025h81214H5713H214H3(H293031)
MFCD08730422
ZINC000009166626
ZINC09166626
ZINC9166626

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Available files

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