Vitas-M small molecule compound
ethyl 2-(4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK737555
SMILES CCOC(=O)c1c2CCCCc2sc1n1cnc2c(c1=O)c1CCCCc1s2
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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 C21H22N2O3S2 MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O3S2/c1-2-26-21(25)17-13-8-4-6-10-15(13)28-20(17)23-11-22-18-16(19(23)24)12-7-3-5-9-14(12)27-18/h11H,2-10H2,1H3InChIKey
PJBOTVZCVDYRGR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)N3C=NC4=C(C3=O)C5=C(S4)CCCC5
ethyl2(4oxo5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)4567tetrahydro1benzothiophene3carboxylate
ethyl2(4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin3yl)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H22N2O3S2c122621(25)17138461015(13)2820(17)2311221816(19(23)24)12735914(12)2718h11H210H21H3
MFCD07658834
ZINC000004784698
ZINC04784698
ZINC4784698
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Check stock on Vitas-MAvailable files
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