Vitas-M small molecule compound
ethyl 3-{[(2-chloro-4-methylphenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK189035
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)C)N1CCN(CC1)C(=O)c1ccccc1
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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 C28H28ClN3O4 MW 506.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28ClN3O4/c1-3-36-28(35)21-10-12-25(24(18-21)30-26(33)22-11-9-19(2)17-23(22)29)31-13-15-32(16-14-31)27(34)20-7-5-4-6-8-20/h4-12,17-18H,3,13-16H2,1-2H3,(H,30,33)InChIKey
NNTAWMSOCWJDCP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=C(C=C(C=C4)C)Cl
ETHYL3(((2CHLORO4METHYLPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
ethyl4(4benzoylpiperazin1yl)3((2chloro4methylbenzoyl)amino)benzoate
InChI=1SC28H28ClN3O4c133628(35)21101225(24(1821)3026(33)2211919(2)1723(22)29)31131532(161431)27(34)207546820h4121718H31316H212H3(H3033)
MFCD06665124
ZINC000009907961
ZINC09907961
ZINC9907961
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