Vitas-M small molecule compound
4-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 3,6-dichloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821191
SMILES Clc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1)/C=N/NC(=O)c1cccc(c1)[N+](=O)[O-]
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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 C23H13Cl2N3O5S MW 514.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13Cl2N3O5S/c24-15-6-9-18-19(11-15)34-21(20(18)25)23(30)33-17-7-4-13(5-8-17)12-26-27-22(29)14-2-1-3-16(10-14)28(31)32/h1-12H,(H,27,29)/b26-12+InChIKey
ZPDSPGJVVWYCLK-RPPGKUMJSA-NSynonyms
(4((E)((3nitrobenzoyl)hydrazinylidene)methyl)phenyl)36dichloro1benzothiophene2carboxylate
4((E)(2((3nitrophenyl)carbonyl)hydrazinylidene)methyl)phenyl36dichloro1benzothiophene2carboxylate
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl
Clc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1)C=NNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC23H13Cl2N3O5Sc2415691819(1115)3421(20(18)25)23(30)33177413(5817)12262722(29)1421316(1014)28(31)32h112H(H2729)b2612+
MFCD01072183
ZINC000100480790
ZINC100480788
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