Vitas-M small molecule compound
methyl (4-{2,5-dimethyl-3-[(E)-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]-1H-pyrrol-1-yl}phenyl)carbamate
Catalog ID
STK162737
SMILES COC(=O)Nc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/NC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)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 C27H27N5O5 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O5/c1-16-5-7-20(8-6-16)28-24(33)15-31-25(34)23(30-26(31)35)14-19-13-17(2)32(18(19)3)22-11-9-21(10-12-22)29-27(36)37-4/h5-14H,15H2,1-4H3,(H,28,33)(H,29,36)(H,30,35)/b23-14+InChIKey
ADTRGXICHSXVRC-OEAKJJBVSA-NSynonyms
CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)NC(=O)OC)C)NC2=O
COC(=O)Nc1ccc(cc1)n1c(C)cc(c1C)C=C1NC(=O)N(C1=O)CC(=O)Nc1ccc(cc1)C
InChI=1SC27H27N5O5c1165720(8616)2824(33)153125(34)23(3026(31)35)14191317(2)32(18(19)3)2211921(101222)2927(36)374h514H15H214H3(H2833)(H2936)(H3035)b2314+
METHYL(4(25DIMETHYL3((E)(1(2((4METHYLPHENYL)AMINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)1HPYRROL1YL)PHENYL)CARBAMATE
METHYLN(4(25DIMETHYL3((E)(1(2(4METHYLANILINO)2OXOETHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)PYRROL1YL)PHENYL)CARBAMATE
MFCD04308396
ZINC000009846163
ZINC09846163
ZINC9846163
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.