Vitas-M small molecule compound

5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-fluorobenzyl)sulfonyl]pyrimidine-4-carboxamide

Catalog ID
STK516806
SMILES COc1cc(CCNC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(cc2)F)ccc1OC

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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 C22H21ClFN3O5S MW 493.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFN3O5S/c1-31-18-8-5-14(11-19(18)32-2)9-10-25-21(28)20-17(23)12-26-22(27-20)33(29,30)13-15-3-6-16(24)7-4-15/h3-8,11-12H,9-10,13H2,1-2H3,(H,25,28)
InChIKey
ZJPUUEHDRGLBMN-UHFFFAOYSA-N
Synonyms

5chloroN(2(34dimethoxyphenyl)ethyl)2((4fluorobenzyl)sulfonyl)pyrimidine4carboxamide
5chloroN(2(34dimethoxyphenyl)ethyl)2((4fluorophenyl)methylsulfonyl)pyrimidine4carboxamide
COC1=C(C=C(C=C1)CCNC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)CC3=CC=C(C=C3)F)OC
InChI=1SC22H21ClFN3O5Sc131188514(1119(18)322)9102521(28)2017(23)122622(2720)33(2930)13153616(24)7415h381112H91013H212H3(H2528)
MFCD08548753
ZINC000012062648
ZINC12062648

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Available files

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