Vitas-M small molecule compound
ethyl 4-({[(4-oxo-6-propyl-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL129098
SMILES CCCN1CCc2c(C1)c(=O)[nH]c(n2)SCC(=O)Nc1ccc(cc1)C(=O)OCC
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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 C21H26N4O4S MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O4S/c1-3-10-25-11-9-17-16(12-25)19(27)24-21(23-17)30-13-18(26)22-15-7-5-14(6-8-15)20(28)29-4-2/h5-8H,3-4,9-13H2,1-2H3,(H,22,26)(H,23,24,27)InChIKey
DXLLJSLDQXQESN-UHFFFAOYSA-NSynonyms
CCCN1CCC2=C(C1)C(=O)N=C(N2)SCC(=O)NC3=CC=C(C=C3)C(=O)OCC
CCCN1CCc2c(C1)c(=O)(nH)c(n2)SCC(=O)Nc1ccc(cc1)C(=O)OCC
ethyl4((((4oxo6propyl345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl4((2((4oxo6propyl1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
InChI=1SC21H26N4O4Sc1310251191716(1225)19(27)2421(2317)301318(26)22157514(6815)20(28)2942h58H34913H212H3(H2226)(H232427)
MFCD20742974
ZINC000067291717
ZINC67291717
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