Vitas-M small molecule compound
methyl (4Z)-2-methyl-4-(4-methylbenzylidene)-5-oxo-1-(tetrahydrofuran-2-ylmethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK804841
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C)CC1CCCO1
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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 C20H23NO4 MW 341.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO4/c1-13-6-8-15(9-7-13)11-17-18(20(23)24-3)14(2)21(19(17)22)12-16-5-4-10-25-16/h6-9,11,16H,4-5,10,12H2,1-3H3/b17-11-InChIKey
OHMDHFIAFFRJQE-BOPFTXTBSA-NSynonyms
(Z)methyl2methyl4(4methylbenzylidene)5oxo1((tetrahydrofuran2yl)methyl)45dihydro1Hpyrrole3carboxylate
CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)CC3CCCO3)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C)CC1CCCO1
InChI=1SC20H23NO4c1136815(9713)111718(20(23)243)14(2)21(19(17)22)121654102516h691116H451012H213H3b1711
METHYL(4Z)2METHYL4((4METHYLPHENYL)METHYLIDENE)5OXO1(OXOLAN2YLMETHYL)PYRROLE3CARBOXYLATE
methyl(4Z)2methyl4(4methylbenzylidene)5oxo1(tetrahydrofuran2ylmethyl)45dihydro1Hpyrrole3carboxylate
MFCD01829761
ZINC000013785534
ZINC000013785536
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