Vitas-M small molecule compound
methyl (4Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-5-oxo-4-(thiophen-2-ylmethylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK053887
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cccs1)CCc1ccc(c(c1)OC)OC
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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 C22H23NO5S MW 413.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5S/c1-14-20(22(25)28-4)17(13-16-6-5-11-29-16)21(24)23(14)10-9-15-7-8-18(26-2)19(12-15)27-3/h5-8,11-13H,9-10H2,1-4H3/b17-13-InChIKey
BFMAWHZASOBYHU-LGMDPLHJSA-NSynonyms
CC1=C(C(=CC2=CC=CS2)C(=O)N1CCC3=CC(=C(C=C3)OC)OC)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cccs1)CCc1ccc(c(c1)OC)OC
InChI=1SC22H23NO5Sc11420(22(25)284)17(131665112916)21(24)23(14)109157818(262)19(1215)273h581113H910H214H3b1713
METHYL(4Z)1(2(34DIMETHOXYPHENYL)ETHYL)2METHYL5OXO4(THIOPHEN2YLMETHYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)1(2(34DIMETHOXYPHENYL)ETHYL)2METHYL5OXO4(THIOPHEN2YLMETHYLIDENE)PYRROLE3CARBOXYLATE
MFCD02921530
STK053887
ZINC000000657263
ZINC00657263
ZINC657263
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