Vitas-M small molecule compound

methyl 4-[(E)-(2-{[1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]carbonyl}hydrazinylidene)methyl]benzoate

Catalog ID
STK874008
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)C1CC(=O)N(C1)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 C20H18ClN3O4 MW 399.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O4/c1-28-20(27)14-4-2-13(3-5-14)11-22-23-19(26)15-10-18(25)24(12-15)17-8-6-16(21)7-9-17/h2-9,11,15H,10,12H2,1H3,(H,23,26)/b22-11+
InChIKey
NXSWXLKPEHKZLF-SSDVNMTOSA-N
Synonyms

(E)methyl4((2(1(4chlorophenyl)5oxopyrrolidine3carbonyl)hydrazono)methyl)benzoate
COC(=O)C1=CC=C(C=C1)C=NNC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)Cl
COC(=O)c1ccc(cc1)C=NNC(=O)C1CC(=O)N(C1)c1ccc(cc1)Cl
InChI=1SC20H18ClN3O4c12820(27)144213(3514)11222319(26)151018(25)24(1215)178616(21)7917h291115H1012H21H3(H2326)b2211+
METHYL4((E)((1(4CHLOROPHENYL)5OXOPYRROLIDINE3CARBONYL)HYDRAZINYLIDENE)METHYL)BENZOATE
methyl4((E)(2((1(4chlorophenyl)5oxopyrrolidin3yl)carbonyl)hydrazinylidene)methyl)benzoate
MFCD00492082
ZINC000001211401
ZINC000001211403

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.