Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(4-nitrobenzyl)-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione
Catalog ID
STK829886
SMILES Clc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n(c1=O)Cc1ccc(cc1)[N+](=O)[O-]
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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 C22H16ClN3O4S MW 453.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O4S/c23-14-6-10-15(11-7-14)25-20(27)19-17-2-1-3-18(17)31-21(19)24(22(25)28)12-13-4-8-16(9-5-13)26(29)30/h4-11H,1-3,12H2InChIKey
SGQKOPQCSBJNNM-UHFFFAOYSA-NSynonyms
674354-71-32(4chlorophenyl)4((4nitrophenyl)methyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidine13dione
3(4chlorophenyl)1(4nitrobenzyl)1567tetrahydro2Hcyclopenta(45)thieno(23d)pyrimidine24(3H)dione
3(4chlorophenyl)1(4nitrobenzyl)67dihydro1Hcyclopenta(45)thieno(23d)pyrimidine24(3H5H)dione
674354713
C1CC2=C(C1)SC3=C2C(=O)N(C(=O)N3CC4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Cl
Clc1ccc(cc1)n1c(=O)c2c3CCCc3sc2n(c1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H16ClN3O4Sc231461015(11714)2520(27)191721318(17)3121(19)24(22(25)28)12134816(9513)26(29)30h411H1312H2
MFCD04008637
ZINC000001311263
ZINC01311263
ZINC1311263
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