Vitas-M small molecule compound
tert-butyl 4-{4-amino-5-[(5-chloro-2-methoxyphenyl)sulfonyl]pyrimidin-2-yl}piperazine-1-carboxylate
Catalog ID
STL167507
SMILES COc1ccc(cc1S(=O)(=O)c1cnc(nc1N)N1CCN(CC1)C(=O)OC(C)(C)C)Cl
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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 C20H26ClN5O5S MW 483.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26ClN5O5S/c1-20(2,3)31-19(27)26-9-7-25(8-10-26)18-23-12-16(17(22)24-18)32(28,29)15-11-13(21)5-6-14(15)30-4/h5-6,11-12H,7-10H2,1-4H3,(H2,22,23,24)InChIKey
VTMYRPDBBBNZIO-UHFFFAOYSA-NSynonyms
CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=C(C(=N2)N)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC
InChI=1SC20H26ClN5O5Sc120(23)3119(27)269725(81026)18231216(17(22)2418)32(2829)151113(21)5614(15)304h561112H710H214H3(H2222324)
MFCD20751846
tertbutyl4(4amino5((5chloro2methoxyphenyl)sulfonyl)pyrimidin2yl)piperazine1carboxylate
tertbutyl4(4amino5(5chloro2methoxyphenyl)sulfonylpyrimidin2yl)piperazine1carboxylate
ZINC000071771967
ZINC71771967
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