Vitas-M small molecule compound
methyl (4Z)-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4-(thiophen-2-ylmethylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168486
SMILES CCOc1ccc(cc1)N1C(=O)/C(=C\c2cccs2)/C(=C1C)C(=O)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 C20H19NO4S MW 369.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4S/c1-4-25-15-9-7-14(8-10-15)21-13(2)18(20(23)24-3)17(19(21)22)12-16-6-5-11-26-16/h5-12H,4H2,1-3H3/b17-12-InChIKey
LCJNLHGQAFKWLI-ATVHPVEESA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=CS3)C2=O)C(=O)OC)C
CCOc1ccc(cc1)N1C(=O)C(=Cc2cccs2)C(=C1C)C(=O)OC
InChI=1SC20H19NO4Sc1425159714(81015)2113(2)18(20(23)243)17(19(21)22)121665112616h512H4H213H3b1712
METHYL(4Z)1(4ETHOXYPHENYL)2METHYL5OXO4(THIOPHEN2YLMETHYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)1(4ETHOXYPHENYL)2METHYL5OXO4(THIOPHEN2YLMETHYLIDENE)PYRROLE3CARBOXYLATE
METHYL1(4ETHOXYPHENYL)2METHYL5OXO4(2THIENYLMETHYLENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03269827
ZINC000001105903
ZINC01105903
ZINC1105903
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