Vitas-M small molecule compound
3-(4-chlorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STL338711
SMILES Clc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nc2c(c1=O)c1CCCc1s2
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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 C22H16ClN3O3S2 MW 469.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S2/c23-14-6-10-15(11-7-14)25-21(27)19-17-2-1-3-18(17)31-20(19)24-22(25)30-12-13-4-8-16(9-5-13)26(28)29/h4-11H,1-3,12H2InChIKey
FTOZPEWZVWEUBM-UHFFFAOYSA-NSynonyms
155950-86-0155950860
2(4chlorophenyl)3((4nitrophenyl)methylsulfanyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
3(4chlorophenyl)2((4nitrobenzyl)sulfanyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
3(4chlorophenyl)2((4nitrobenzyl)thio)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Cl
Clc1ccc(cc1)n1c(SCc2ccc(cc2)(N+)(=O)(O))nc2c(c1=O)c1CCCc1s2
InChI=1SC22H16ClN3O3S2c231461015(11714)2521(27)191721318(17)3120(19)2422(25)3012134816(9513)26(28)29h411H1312H2
MFCD03224744
ZINC000001841644
ZINC01841644
ZINC1841644
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