Vitas-M small molecule compound
methyl (4Z)-4-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168551
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(cc1)OC)C)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 C25H30N2O4 MW 422.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4/c1-15(2)14-26-18(5)23(25(29)31-7)22(24(26)28)13-19-12-16(3)27(17(19)4)20-8-10-21(30-6)11-9-20/h8-13,15H,14H2,1-7H3/b22-13-InChIKey
BBHIUHKZMUPUJQ-XKZIYDEJSA-NSynonyms
CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C3C(=C(N(C3=O)CC(C)C)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(cc1)OC)C)CC(C)C
InChI=1SC25H30N2O4c115(2)142618(5)23(25(29)317)22(24(26)28)13191216(3)27(17(19)4)2081021(306)11920h81315H14H217H3b2213
METHYL(4Z)4((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL1(2METHYLPROPYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(4METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL1(2METHYLPROPYL)5OXOPYRROLE3CARBOXYLATE
MFCD02951780
ZINC000014010562
ZINC14010562
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