Vitas-M small molecule compound
4-chloro-2-(2,5-dimethyl-1H-pyrrol-1-yl)phenyl 3,4-dimethoxybenzoate
Catalog ID
STL416426
SMILES COc1cc(ccc1OC)C(=O)Oc1ccc(cc1n1c(C)ccc1C)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 C21H20ClNO4 MW 385.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClNO4/c1-13-5-6-14(2)23(13)17-12-16(22)8-10-18(17)27-21(24)15-7-9-19(25-3)20(11-15)26-4/h5-12H,1-4H3InChIKey
KKWBYBCNBTYVNF-UHFFFAOYSA-NSynonyms
(4chloro2(25dimethylpyrrol1yl)phenyl)34dimethoxybenzoate
4chloro2(25dimethyl1Hpyrrol1yl)phenyl34dimethoxybenzoate
CC1=CC=C(N1C2=C(C=CC(=C2)Cl)OC(=O)C3=CC(=C(C=C3)OC)OC)C
InChI=1SC21H20ClNO4c1135614(2)23(13)171216(22)81018(17)2721(24)157919(253)20(1115)264h512H14H3
MFCD02903860
ZINC000005659403
ZINC5659403
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