Vitas-M small molecule compound
4-[(E)-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]imino}methyl]-2-ethoxyphenyl 2-chlorobenzoate
Catalog ID
STK068193
SMILES CCOc1cc(/C=N/c2cc(nn2c2ccccc2)c2ccc(cc2)Cl)ccc1OC(=O)c1ccccc1Cl
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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 C31H23Cl2N3O3 MW 556.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23Cl2N3O3/c1-2-38-29-18-21(12-17-28(29)39-31(37)25-10-6-7-11-26(25)33)20-34-30-19-27(22-13-15-23(32)16-14-22)35-36(30)24-8-4-3-5-9-24/h3-20H,2H2,1H3/b34-20+InChIKey
FDPTUQDRSKRTJS-QXUDOOCXSA-NSynonyms
(4((E)(5(4chlorophenyl)2phenylpyrazol3yl)iminomethyl)2ethoxyphenyl)2chlorobenzoate
4((E)((3(4CHLOROPHENYL)1PHENYL1HPYRAZOL5YL)IMINO)METHYL)2ETHOXYPHENYL2CHLOROBENZOATE
CCOC1=C(C=CC(=C1)C=NC2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)OC(=O)C5=CC=CC=C5Cl
CCOc1cc(C=Nc2cc(nn2c2ccccc2)c2ccc(cc2)Cl)ccc1OC(=O)c1ccccc1Cl
InChI=1SC31H23Cl2N3O3c1238291821(121728(29)3931(37)2510671126(25)33)2034301927(22131523(32)161422)3536(30)248435924h320H2H21H3b3420+
MFCD01964130
STK068193
ZINC000097958898
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