Vitas-M small molecule compound
4-(benzylsulfanyl)-3-chloro-6-nitro-2-phenyl-1-benzothiophene
Catalog ID
STK692664
SMILES Clc1c(sc2c1c(SCc1ccccc1)cc(c2)[N+](=O)[O-])c1ccccc1
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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 C21H14ClNO2S2 MW 411.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClNO2S2/c22-20-19-17(26-13-14-7-3-1-4-8-14)11-16(23(24)25)12-18(19)27-21(20)15-9-5-2-6-10-15/h1-12H,13H2InChIKey
ZHYBVBMNGYEHOW-UHFFFAOYSA-NSynonyms
4(benzylsulfanyl)3chloro6nitro2phenyl1benzothiophene
4benzylsulfanyl3chloro6nitro2phenyl1benzothiophene
C1=CC=C(C=C1)CSC2=CC(=CC3=C2C(=C(S3)C4=CC=CC=C4)Cl)(N+)(=O)(O)
Clc1c(sc2c1c(SCc1ccccc1)cc(c2)(N+)(=O)(O))c1ccccc1
InChI=1SC21H14ClNO2S2c22201917(2613147314814)1116(23(24)25)1218(19)2721(20)1595261015h112H13H2
MFCD10038712
ZINC000015084477
ZINC15084477
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