Vitas-M small molecule compound

2-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1,3-benzothiazole

Catalog ID
STK735243
SMILES COc1ccc(cc1[N+](=O)[O-])CSc1nc2c(s1)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 C15H12N2O3S2 MW 332.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N2O3S2/c1-20-13-7-6-10(8-12(13)17(18)19)9-21-15-16-11-4-2-3-5-14(11)22-15/h2-8H,9H2,1H3
InChIKey
AGMOYBSXRXYPHG-UHFFFAOYSA-N
Synonyms
311317-07-4
2((4methoxy3nitrobenzyl)sulfanyl)13benzothiazole
2((4methoxy3nitrobenzyl)thio)benzo(d)thiazole
2((4METHOXY3NITROPHENYL)METHYLSULFANYL)13BENZOTHIAZOLE
2(4METHOXY3NITROBENZYLSULFANYL)BENZOTHIAZOLE
311317074
4(BENZOTHIAZOL2YLTHIOMETHYL)1METHOXY2NITROBENZENE
COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3S2)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))CSc1nc2c(s1)cccc2
InChI=1SC15H12N2O3S2c120137610(812(13)17(18)19)921151611423514(11)2215h28H9H21H3
MFCD00754595
ZINC000000033174
ZINC00033174
ZINC33174

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Available files

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