Vitas-M small molecule compound
methyl N-{[1-(2-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]carbonyl}-beta-alaninate
Catalog ID
STL312094
SMILES COC(=O)CCNC(=O)c1cc(n(c1C)c1ccccc1OC)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 C18H22N2O4 MW 330.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O4/c1-12-11-14(18(22)19-10-9-17(21)24-4)13(2)20(12)15-7-5-6-8-16(15)23-3/h5-8,11H,9-10H2,1-4H3,(H,19,22)InChIKey
PVBNMJBZIVLFDF-UHFFFAOYSA-NSynonyms
1442076-35-81442076358
CC1=CC(=C(N1C2=CC=CC=C2OC)C)C(=O)NCCC(=O)OC
InChI=1SC18H22N2O4c1121114(18(22)1910917(21)244)13(2)20(12)15756816(15)233h5811H910H214H3(H1922)
methyl3((1(2methoxyphenyl)25dimethylpyrrole3carbonyl)amino)propanoate
methyl3(1(2methoxyphenyl)25dimethyl1Hpyrrole3carboxamido)propanoate
methylN((1(2methoxyphenyl)25dimethyl1Hpyrrol3yl)carbonyl)betaalaninate
MFCD28026465
ZINC000095474529
ZINC95474529
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