Vitas-M small molecule compound
ethyl 3-{[(5-bromonaphthalen-1-yl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK219930
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1cccc2c1cccc2Br)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 C31H28BrN3O4 MW 586.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28BrN3O4/c1-2-39-31(38)22-14-15-28(34-16-18-35(19-17-34)30(37)21-8-4-3-5-9-21)27(20-22)33-29(36)25-12-6-11-24-23(25)10-7-13-26(24)32/h3-15,20H,2,16-19H2,1H3,(H,33,36)InChIKey
ZTTBUEMHENSGJB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC5=C4C=CC=C5Br
ETHYL3(((5BROMONAPHTHALEN1YL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
ethyl4(4benzoylpiperazin1yl)3((5bromonaphthalene1carbonyl)amino)benzoate
InChI=1SC31H28BrN3O4c123931(38)22141528(34161835(191734)30(37)218435921)27(2022)3329(36)25126112423(25)1071326(24)32h31520H21619H21H3(H3336)
MFCD06665419
ZINC000097948616
ZINC97948616
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