Vitas-M small molecule compound
(4Z)-4-{4-[bis(2-chloroethyl)amino]benzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STL430966
SMILES ClCCN(c1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1ccccc1)CCCl
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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 C20H19Cl2N3O2 MW 404.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Cl2N3O2/c21-10-12-24(13-11-22)16-8-6-15(7-9-16)14-18-19(26)23-25(20(18)27)17-4-2-1-3-5-17/h1-9,14H,10-13H2,(H,23,26)/b18-14-InChIKey
VIDLUBVUYIZWEN-JXAWBTAJSA-NSynonyms
(4Z)4((4(BIS(2CHLOROETHYL)AMINO)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4Z)4(4(bis(2chloroethyl)amino)benzylidene)1phenylpyrazolidine35dione
C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)N(CCCl)CCCl)C(=O)N2
ClCCN(c1ccc(cc1)C=C1C(=O)NN(C1=O)c1ccccc1)CCCl
InChI=1SC20H19Cl2N3O2c21101224(131122)168615(7916)141819(26)2325(20(18)27)174213517h1914H1013H2(H2326)b1814
MFCD01446194
ZINC000100281277
ZINC100281277
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