Vitas-M small molecule compound
ethyl 3-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK195267
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)/C=C/c1ccco1)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 C27H27N3O5 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O5/c1-2-34-27(33)21-10-12-24(23(19-21)28-25(31)13-11-22-9-6-18-35-22)29-14-16-30(17-15-29)26(32)20-7-4-3-5-8-20/h3-13,18-19H,2,14-17H2,1H3,(H,28,31)/b13-11+InChIKey
ZBYGOUUSINOQDG-ACCUITESSA-NSynonyms
CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C=CC4=CC=CO4
CCOC(=O)c1ccc(c(c1)NC(=O)C=Cc1ccco1)N1CCN(CC1)C(=O)c1ccccc1
ETHYL3(((2E)3(FURAN2YL)PROP2ENOYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
ethyl4(4benzoylpiperazin1yl)3(((E)3(furan2yl)prop2enoyl)amino)benzoate
InChI=1SC27H27N3O5c123427(33)21101224(23(1921)2825(31)13112296183522)29141630(171529)26(32)207435820h3131819H21417H21H3(H2831)b1311+
MFCD06665731
ZINC000009933677
ZINC09933677
ZINC9933677
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