Vitas-M small molecule compound
5-[(4-chlorobenzyl)(furan-2-ylmethyl)amino]-2-(methylsulfonyl)pyrimidine-4-carboxylic acid
Catalog ID
STK913371
SMILES Clc1ccc(cc1)CN(c1cnc(nc1C(=O)O)S(=O)(=O)C)Cc1ccco1
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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 C18H16ClN3O5S MW 421.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClN3O5S/c1-28(25,26)18-20-9-15(16(21-18)17(23)24)22(11-14-3-2-8-27-14)10-12-4-6-13(19)7-5-12/h2-9H,10-11H2,1H3,(H,23,24)InChIKey
WLYILSFWOIHQGZ-UHFFFAOYSA-NSynonyms
5((4chlorobenzyl)(furan2ylmethyl)amino)2(methylsulfonyl)pyrimidine4carboxylicacid
5((4chlorophenyl)methyl(furan2ylmethyl)amino)2methylsulfonylpyrimidine4carboxylicacid
CS(=O)(=O)C1=NC=C(C(=N1)C(=O)O)N(CC2=CC=C(C=C2)Cl)CC3=CC=CO3
InChI=1SC18H16ClN3O5Sc128(2526)1820915(16(2118)17(23)24)22(11143282714)10124613(19)7512h29H1011H21H3(H2324)
MFCD07428326
ZINC000012062558
ZINC12062558
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