Vitas-M small molecule compound
2-{(2E)-2-[5-nitro-2-(3-phenoxypropoxy)benzylidene]hydrazinyl}-1,3-benzothiazole
Catalog ID
STK072975
SMILES [O-][N+](=O)c1ccc(c(c1)/C=N/Nc1nc2c(s1)cccc2)OCCCOc1ccccc1
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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 C23H20N4O4S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S/c28-27(29)18-11-12-21(31-14-6-13-30-19-7-2-1-3-8-19)17(15-18)16-24-26-23-25-20-9-4-5-10-22(20)32-23/h1-5,7-12,15-16H,6,13-14H2,(H,25,26)/b24-16+InChIKey
CIMPAWGZUMXNIW-LFVJCYFKSA-NSynonyms
(O)(N+)(=O)c1ccc(c(c1)C=NNc1nc2c(s1)cccc2)OCCCOc1ccccc1
2((2E)2(5NITRO2(3PHENOXYPROPOXY)BENZYLIDENE)HYDRAZINYL)13BENZOTHIAZOLE
C1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2)(N+)(=O)(O))C=NNC3=NC4=CC=CC=C4S3
InChI=1SC23H20N4O4Sc2827(29)18111221(311461330197213819)17(1518)1624262325209451022(20)3223h157121516H61314H2(H2526)b2416+
MFCD08672948
N((E)(5nitro2(3phenoxypropoxy)phenyl)methylideneamino)13benzothiazol2amine
STK072975
ZINC000013898932
ZINC96488934
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