Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(4-butoxy-3-methoxyphenyl)-2-cyanoprop-2-enoyl]amino}benzoate
Catalog ID
STK949922
SMILES CCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ccccc1C(=O)OCC)\C#N
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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 C24H26N2O5 MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O5/c1-4-6-13-31-21-12-11-17(15-22(21)29-3)14-18(16-25)23(27)26-20-10-8-7-9-19(20)24(28)30-5-2/h7-12,14-15H,4-6,13H2,1-3H3,(H,26,27)/b18-14+InChIKey
PBGUKWHENCQTID-NBVRZTHBSA-NSynonyms
CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)OCC)OC
CCCCOc1ccc(cc1OC)C=C(C(=O)Nc1ccccc1C(=O)OCC)C#N
ethyl2(((2E)3(4butoxy3methoxyphenyl)2cyanoprop2enoyl)amino)benzoate
ETHYL2(((E)3(4BUTOXY3METHOXYPHENYL)2CYANOPROP2ENOYL)AMINO)BENZOATE
ETHYL2((2E)3(4BUTOXY3METHOXYPHENYL)2CYANOPROP2ENOYLAMINO)BENZOATE
InChI=1SC24H26N2O5c146133121121117(1522(21)293)1418(1625)23(27)26201087919(20)24(28)3052h7121415H4613H213H3(H2627)b1814+
MFCD02957069
ZINC000002670461
ZINC02670461
ZINC2670461
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