Vitas-M small molecule compound

3-chloro-N'-{(E)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophene-2-carbohydrazide

Catalog ID
STK745222
SMILES Clc1ccc(cc1c1ccc(o1)/C=N/NC(=O)c1sc2c(c1Cl)cccc2)[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 C20H11Cl2N3O4S MW 460.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H11Cl2N3O4S/c21-15-7-5-11(25(27)28)9-14(15)16-8-6-12(29-16)10-23-24-20(26)19-18(22)13-3-1-2-4-17(13)30-19/h1-10H,(H,24,26)/b23-10+
InChIKey
UESTVEXFSZKISV-AUEPDCJTSA-N
Synonyms

3chloroN((5(2chloro5nitrophenyl)furan2yl)methylene)benzo(b)thiophene2carbohydrazide
3chloroN((E)(5(2chloro5nitrophenyl)furan2yl)methylidene)1benzothiophene2carbohydrazide
3CHLORON((E)(5(2CHLORO5NITROPHENYL)FURAN2YL)METHYLIDENEAMINO)1BENZOTHIOPHENE2CARBOXAMIDE
C1=CC=C2C(=C1)C(=C(S2)C(=O)NN=CC3=CC=C(O3)C4=C(C=CC(=C4)(N+)(=O)(O))Cl)Cl
Clc1ccc(cc1c1ccc(o1)C=NNC(=O)c1sc2c(c1Cl)cccc2)(N+)(=O)(O)
InChI=1SC20H11Cl2N3O4Sc21157511(25(27)28)914(15)168612(2916)10232420(26)1918(22)13312417(13)3019h110H(H2426)b2310+
MFCD02240832
ZINC000001783936
ZINC33343509

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.