Vitas-M small molecule compound

N'-[(3Z)-5-bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-3-chloro-1-benzothiophene-2-carbohydrazide

Catalog ID
STK745221
SMILES CCCCN1C(=O)/C(=N\NC(=O)c2sc3c(c2Cl)cccc3)/c2c1ccc(c2)Br

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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 C21H17BrClN3O2S MW 490.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrClN3O2S/c1-2-3-10-26-15-9-8-12(22)11-14(15)18(21(26)28)24-25-20(27)19-17(23)13-6-4-5-7-16(13)29-19/h4-9,11H,2-3,10H2,1H3,(H,25,27)/b24-18-
InChIKey
JOEUSPSRFQZBKH-MOHJPFBDSA-N
Synonyms

(Z)N(5bromo1butyl2oxoindolin3ylidene)3chlorobenzo(b)thiophene2carbohydrazide
CCCCN1C(=O)C(=NNC(=O)c2sc3c(c2Cl)cccc3)c2c1ccc(c2)Br
CCCCN1C2=C(C=C(C=C2)Br)C(=NNC(=O)C3=C(C4=CC=CC=C4S3)Cl)C1=O
InChI=1SC21H17BrClN3O2Sc1231026159812(22)1114(15)18(21(26)28)242520(27)1917(23)13645716(13)2919h4911H2310H21H3(H2527)b2418
MFCD02234472
N((3Z)5bromo1butyl2oxo12dihydro3Hindol3ylidene)3chloro1benzothiophene2carbohydrazide
N((Z)(5BROMO1BUTYL2OXOINDOL3YLIDENE)AMINO)3CHLORO1BENZOTHIOPHENE2CARBOXAMIDE
ZINC000002292557
ZINC100175872

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Available files

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