Vitas-M small molecule compound

3-chloro-N'-[(E)-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}methylidene]-1-benzothiophene-2-carbohydrazide

Catalog ID
STK831619
SMILES COc1ccc(cc1CSc1ccccn1)/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 C23H18ClN3O2S2 MW 468.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O2S2/c1-29-18-10-9-15(12-16(18)14-30-20-8-4-5-11-25-20)13-26-27-23(28)22-21(24)17-6-2-3-7-19(17)31-22/h2-13H,14H2,1H3,(H,27,28)/b26-13+
InChIKey
VITBPTKIYWYNHC-LGJNPRDNSA-N
Synonyms
352660-87-8
(E)3chloroN(4methoxy3((pyridin2ylthio)methyl)benzylidene)benzo(b)thiophene2carbohydrazide
352660878
3chloroN((E)(4methoxy3((pyridin2ylsulfanyl)methyl)phenyl)methylidene)1benzothiophene2carbohydrazide
3CHLORON((E)(4METHOXY3(PYRIDIN2YLSULFANYLMETHYL)PHENYL)METHYLIDENEAMINO)1BENZOTHIOPHENE2CARBOXAMIDE
3CHLORON(4METHOXY3((2PYRIDINYLSULFANYL)METHYL)BENZYLIDENE)1BENZOTHIOPHENE2CARBOHYDRAZIDE
COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C3=CC=CC=C3S2)Cl)CSC4=CC=CC=N4
COc1ccc(cc1CSc1ccccn1)C=NNC(=O)c1sc2c(c1Cl)cccc2
InChI=1SC23H18ClN3O2S2c1291810915(1216(18)143020845112520)13262723(28)2221(24)17623719(17)3122h213H14H21H3(H2728)b2613+
MFCD01875394
ZINC000008432240
ZINC33352012

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Available files

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