Vitas-M small molecule compound
ethyl (5E)-2-methyl-4-oxo-5-[4-(propan-2-yl)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK159976
SMILES CCOC(=O)C1=C(C)N/C(=C/c2ccc(cc2)C(C)C)/C1=O
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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 C18H21NO3 MW 299.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO3/c1-5-22-18(21)16-12(4)19-15(17(16)20)10-13-6-8-14(9-7-13)11(2)3/h6-11,19H,5H2,1-4H3/b15-10+InChIKey
LAEKNIVSTWWDKJ-XNTDXEJSSA-NSynonyms
CCOC(=O)C1=C(C)NC(=Cc2ccc(cc2)C(C)C)C1=O
CCOC(=O)C1=C(NC(=CC2=CC=C(C=C2)C(C)C)C1=O)C
ETHYL(5E)2METHYL4OXO5((4PROPAN2YLPHENYL)METHYLIDENE)1HPYRROLE3CARBOXYLATE
ETHYL(5E)2METHYL4OXO5(4(PROPAN2YL)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL5(4ISOPROPYLBENZYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL5METHYL2((4(METHYLETHYL)PHENYL)METHYLENE)3OXOAZOLINE4CARBOXYLATE
InChI=1SC18H21NO3c152218(21)1612(4)1915(17(16)20)10136814(9713)11(2)3h61119H5H214H3b1510+
MFCD00846744
ZINC000002076722
ZINC02076722
ZINC2076722
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