Vitas-M small molecule compound
methyl 5-[(2E)-3-(4-chlorophenyl)prop-2-enoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Catalog ID
STL323066
SMILES COC(=O)c1c(C)[nH]c(c1C)C(=O)/C=C/c1ccc(cc1)Cl
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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 C17H16ClNO3 MW 317.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO3/c1-10-15(17(21)22-3)11(2)19-16(10)14(20)9-6-12-4-7-13(18)8-5-12/h4-9,19H,1-3H3/b9-6+InChIKey
ATIHPHSPMMESGT-RMKNXTFCSA-NSynonyms
1164478-08-3(E)methyl5(3(4chlorophenyl)acryloyl)24dimethyl1Hpyrrole3carboxylate
1164478083
5((E)3(4CHLOROPHENYL)ACRYLOYL)24DIMETHYL1HPYRROLE3CARBOXYLICACIDMETHYLESTER
CC1=C(NC(=C1C(=O)OC)C)C(=O)C=CC2=CC=C(C=C2)Cl
COC(=O)c1c(C)(nH)c(c1C)C(=O)C=Cc1ccc(cc1)Cl
InChI=1SC17H16ClNO3c11015(17(21)223)11(2)1916(10)14(20)96124713(18)8512h4919H13H3b96+
methyl5((2E)3(4chlorophenyl)prop2enoyl)24dimethyl1Hpyrrole3carboxylate
METHYL5((E)3(4CHLOROPHENYL)PROP2ENOYL)24DIMETHYL1HPYRROLE3CARBOXYLATE
MFCD01555870
ZINC000004772850
ZINC04772850
ZINC4772850
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