Vitas-M small molecule compound
methyl (4Z)-1-cyclohexyl-2-methyl-4-(4-methylbenzylidene)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL330523
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)C)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 C21H25NO3 MW 339.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO3/c1-14-9-11-16(12-10-14)13-18-19(21(24)25-3)15(2)22(20(18)23)17-7-5-4-6-8-17/h9-13,17H,4-8H2,1-3H3/b18-13-InChIKey
JDWOVWICAZRHHD-AQTBWJFISA-NSynonyms
(Z)methyl1cyclohexyl2methyl4(4methylbenzylidene)5oxo45dihydro1Hpyrrole3carboxylate
CC1=CC=C(C=C1)C=C2C(=C(N(C2=O)C3CCCCC3)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)C)C1CCCCC1
InChI=1SC21H25NO3c11491116(121014)131819(21(24)253)15(2)22(20(18)23)177546817h91317H48H213H3b1813
METHYL(4Z)1CYCLOHEXYL2METHYL4((4METHYLPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
methyl(4Z)1cyclohexyl2methyl4(4methylbenzylidene)5oxo45dihydro1Hpyrrole3carboxylate
MFCD01060533
ZINC000013810066
ZINC13810066
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