Vitas-M small molecule compound
methyl (4Z)-4-{[1-(3,5-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-methoxybenzyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161532
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1cc(C)cc(c1)C)C)Cc1ccc(cc1)OC
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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 C30H32N2O4 MW 484.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O4/c1-18-12-19(2)14-25(13-18)32-20(3)15-24(21(32)4)16-27-28(30(34)36-7)22(5)31(29(27)33)17-23-8-10-26(35-6)11-9-23/h8-16H,17H2,1-7H3/b27-16-InChIKey
SOUQRQFRKAJYAS-YUMHPJSZSA-NSynonyms
CC1=CC(=CC(=C1)N2C(=CC(=C2C)C=C3C(=C(N(C3=O)CC4=CC=C(C=C4)OC)C)C(=O)OC)C)C
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1cc(C)cc(c1)C)C)Cc1ccc(cc1)OC
InChI=1SC30H32N2O4c1181219(2)1425(1318)3220(3)1524(21(32)4)162728(30(34)367)22(5)31(29(27)33)172381026(356)11923h816H17H217H3b2716
METHYL(4Z)4((1(35DIMETHYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(4METHOXYBENZYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(35DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1((4METHOXYPHENYL)METHYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD03261974
ZINC000014009569
ZINC14009569
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