Vitas-M small molecule compound
methyl (4Z)-4-(3-chlorobenzylidene)-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK698681
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cccc(c1)Cl)CC(C)C
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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 C18H20ClNO3 MW 333.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO3/c1-11(2)10-20-12(3)16(18(22)23-4)15(17(20)21)9-13-6-5-7-14(19)8-13/h5-9,11H,10H2,1-4H3/b15-9-InChIKey
URFTYQCGYIEEIK-DHDCSXOGSA-NSynonyms
(Z)methyl4(3chlorobenzylidene)1isobutyl2methyl5oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=CC2=CC(=CC=C2)Cl)C(=O)N1CC(C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cccc(c1)Cl)CC(C)C
InChI=1SC18H20ClNO3c111(2)102012(3)16(18(22)234)15(17(20)21)91365714(19)813h5911H10H214H3b159
METHYL(4Z)4((3CHLOROPHENYL)METHYLIDENE)2METHYL1(2METHYLPROPYL)5OXOPYRROLE3CARBOXYLATE
methyl(4Z)4(3chlorobenzylidene)2methyl1(2methylpropyl)5oxo45dihydro1Hpyrrole3carboxylate
MFCD01305563
ZINC000000068626
ZINC00068626
ZINC68626
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