Vitas-M small molecule compound
methyl 3-{[(2-chloro-4-methylphenyl)carbonyl]amino}-4-(piperazin-1-yl)benzoate
Catalog ID
STL119703
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)C)N1CCNCC1
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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 C20H22ClN3O3 MW 387.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O3/c1-13-3-5-15(16(21)11-13)19(25)23-17-12-14(20(26)27-2)4-6-18(17)24-9-7-22-8-10-24/h3-6,11-12,22H,7-10H2,1-2H3,(H,23,25)InChIKey
JKGYMBGCVWJNBT-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCNCC3)Cl
InChI=1SC20H22ClN3O3c1133515(16(21)1113)19(25)23171214(20(26)272)4618(17)24972281024h36111222H710H212H3(H2325)
methyl3(((2chloro4methylphenyl)carbonyl)amino)4(piperazin1yl)benzoate
methyl3((2chloro4methylbenzoyl)amino)4piperazin1ylbenzoate
MFCD12128959
ZINC000020357103
ZINC20357103
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