Vitas-M small molecule compound
methyl (4Z)-1-cyclohexyl-2-methyl-5-oxo-4-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168445
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)OCC(=O)NC(c1ccccc1)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 C30H34N2O5 MW 502.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O5/c1-20(23-10-6-4-7-11-23)31-27(33)19-37-25-16-14-22(15-17-25)18-26-28(30(35)36-3)21(2)32(29(26)34)24-12-8-5-9-13-24/h4,6-7,10-11,14-18,20,24H,5,8-9,12-13,19H2,1-3H3,(H,31,33)/b26-18-InChIKey
NGGXBPLOHKNPOX-ITYLOYPMSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)OCC(=O)NC(C)C3=CC=CC=C3)C(=O)N1C4CCCCC4)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)OCC(=O)NC(c1ccccc1)C)C1CCCCC1
InChI=1SC30H34N2O5c120(23106471123)3127(33)193725161422(151725)182628(30(35)363)21(2)32(29(26)34)24128591324h467101114182024H589121319H213H3(H3133)b2618
METHYL(4Z)1CYCLOHEXYL2METHYL5OXO4((4(2OXO2(1PHENYLETHYLAMINO)ETHOXY)PHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
METHYL(4Z)1CYCLOHEXYL2METHYL5OXO4(4(2OXO2((1PHENYLETHYL)AMINO)ETHOXY)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01964299
ZINC000009846950
ZINC000009846951
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