Vitas-M small molecule compound
methyl 4-chloro-3-{[N-(4-methylphenyl)-N-(methylsulfonyl)alanyl]amino}benzoate
Catalog ID
STL071704
SMILES COC(=O)c1ccc(c(c1)NC(=O)C(N(S(=O)(=O)C)c1ccc(cc1)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 C19H21ClN2O5S MW 424.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN2O5S/c1-12-5-8-15(9-6-12)22(28(4,25)26)13(2)18(23)21-17-11-14(19(24)27-3)7-10-16(17)20/h5-11,13H,1-4H3,(H,21,23)InChIKey
LWGFQGUEFXHDSE-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N(C(C)C(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)S(=O)(=O)C
InChI=1SC19H21ClN2O5Sc1125815(9612)22(28(425)26)13(2)18(23)21171114(19(24)273)71016(17)20h51113H14H3(H2123)
methyl4chloro3((N(4methylphenyl)N(methylsulfonyl)alanyl)amino)benzoate
METHYL4CHLORO3((N(4METHYLPHENYL)N(METHYLSULFONYL)LALANYL)AMINO)BENZOATE
METHYL4CHLORO3(2(4METHYLNMETHYLSULFONYLANILINO)PROPANOYLAMINO)BENZOATE
MFCD06001228
ZINC000001057313
ZINC000001057315
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