Vitas-M small molecule compound

(4Z)-4-{4-[bis(2-chloroethyl)amino]benzylidene}-1-(3-chlorophenyl)pyrazolidine-3,5-dione

Catalog ID
STL430982
SMILES ClCCN(c1ccc(cc1)/C=C\1/C(=O)NN(C1=O)c1cccc(c1)Cl)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 C20H18Cl3N3O2 MW 438.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18Cl3N3O2/c21-8-10-25(11-9-22)16-6-4-14(5-7-16)12-18-19(27)24-26(20(18)28)17-3-1-2-15(23)13-17/h1-7,12-13H,8-11H2,(H,24,27)/b18-12-
InChIKey
ZZOSMAGSSXYDDE-PDGQHHTCSA-N
Synonyms

(4Z)4((4(BIS(2CHLOROETHYL)AMINO)PHENYL)METHYLIDENE)1(3CHLOROPHENYL)PYRAZOLIDINE35DIONE
(4Z)4(4(bis(2chloroethyl)amino)benzylidene)1(3chlorophenyl)pyrazolidine35dione
C1=CC(=CC(=C1)Cl)N2C(=O)C(=CC3=CC=C(C=C3)N(CCCl)CCCl)C(=O)N2
ClCCN(c1ccc(cc1)C=C1C(=O)NN(C1=O)c1cccc(c1)Cl)CCCl
InChI=1SC20H18Cl3N3O2c2181025(11922)166414(5716)121819(27)2426(20(18)28)1731215(23)1317h171213H811H2(H2427)b1812
MFCD01446214
ZINC000100281020
ZINC100281020

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Available files

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