Vitas-M small molecule compound
3-chloro-N'-[(E)-{4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl}methylidene]-1-benzothiophene-2-carbohydrazide
Catalog ID
STK926743
SMILES COc1ccc(cc1COc1ccc(cc1)[N+](=O)[O-])/C=N/NC(=O)c1sc2c(c1Cl)cccc2
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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 C24H18ClN3O5S MW 495.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O5S/c1-32-20-11-6-15(12-16(20)14-33-18-9-7-17(8-10-18)28(30)31)13-26-27-24(29)23-22(25)19-4-2-3-5-21(19)34-23/h2-13H,14H2,1H3,(H,27,29)/b26-13+InChIKey
IQZWXCDEVRGIRT-LGJNPRDNSA-NSynonyms
3chloroN((E)(4methoxy3((4nitrophenoxy)methyl)phenyl)methylidene)1benzothiophene2carbohydrazide
3chloroN((E)(4methoxy3((4nitrophenoxy)methyl)phenyl)methylideneamino)1benzothiophene2carboxamide
COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)COC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc(cc1COc1ccc(cc1)(N+)(=O)(O))C=NNC(=O)c1sc2c(c1Cl)cccc2
InChI=1SC24H18ClN3O5Sc1322011615(1216(20)1433189717(81018)28(30)31)13262724(29)2322(25)19423521(19)3423h213H14H21H3(H2729)b2613+
MFCD02764090
ZINC000002754749
ZINC28632617
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