Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[2-(cyclohex-1-en-1-yl)ethyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK065069
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(c(c1)Cl)C)C)CCC1=CCCCC1
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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 C29H33ClN2O3 MW 493.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33ClN2O3/c1-18-11-12-24(17-26(18)30)32-19(2)15-23(20(32)3)16-25-27(29(34)35-5)21(4)31(28(25)33)14-13-22-9-7-6-8-10-22/h9,11-12,15-17H,6-8,10,13-14H2,1-5H3/b25-16-InChIKey
PXZSJESGIISUNN-XYGWBWBKSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=C3C(=C(N(C3=O)CCC4=CCCCC4)C)C(=O)OC)C)Cl
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(c(c1)Cl)C)C)CCC1=CCCCC1
InChI=1SC29H33ClN2O3c118111224(1726(18)30)3219(2)1523(20(32)3)162527(29(34)355)21(4)31(28(25)33)14132297681022h911121517H68101314H215H3b2516
METHYL(4Z)4((1(3CHLORO4METHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(2(CYCLOHEX1EN1YL)ETHYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(3CHLORO4METHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(2(CYCLOHEXEN1YL)ETHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD07065582
STK065069
ZINC000013897615
ZINC13897615
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Check stock on Vitas-MAvailable files
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