Vitas-M small molecule compound
methyl (4Z)-1-(3,5-dichlorophenyl)-2-methyl-5-oxo-4-{[5-({[oxo(phenylamino)acetyl]amino}methyl)furan-2-yl]methylidene}-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165164
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(o1)CNC(=O)C(=O)Nc1ccccc1)c1cc(Cl)cc(c1)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 C27H21Cl2N3O6 MW 554.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21Cl2N3O6/c1-15-23(27(36)37-2)22(26(35)32(15)19-11-16(28)10-17(29)12-19)13-20-8-9-21(38-20)14-30-24(33)25(34)31-18-6-4-3-5-7-18/h3-13H,14H2,1-2H3,(H,30,33)(H,31,34)/b22-13-InChIKey
RFDIIJPACNPTOI-XKZIYDEJSA-NSynonyms
CC1=C(C(=CC2=CC=C(O2)CNC(=O)C(=O)NC3=CC=CC=C3)C(=O)N1C4=CC(=CC(=C4)Cl)Cl)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(o1)CNC(=O)C(=O)Nc1ccccc1)c1cc(Cl)cc(c1)Cl
InChI=1SC27H21Cl2N3O6c11523(27(36)372)22(26(35)32(15)191116(28)1017(29)1219)13208921(3820)143024(33)25(34)31186435718h313H14H212H3(H3033)(H3134)b2213
METHYL(4Z)1(35DICHLOROPHENYL)2METHYL5OXO4((5(((OXO(PHENYLAMINO)ACETYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((5(((2ANILINO2OXOACETYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)1(35DICHLOROPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
MFCD08679489
ZINC000002079938
ZINC2079938
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