Vitas-M small molecule compound

methyl 3-{[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]methyl}benzoate

Catalog ID
STK079279
SMILES CCOc1ccc2c(c1)sc(n2)SCc1cccc(c1)C(=O)OC

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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 C18H17NO3S2 MW 359.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO3S2/c1-3-22-14-7-8-15-16(10-14)24-18(19-15)23-11-12-5-4-6-13(9-12)17(20)21-2/h4-10H,3,11H2,1-2H3
InChIKey
PVLBWGISXRRIGN-UHFFFAOYSA-N
Synonyms
401822-62-6
401822626
CCOC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC(=C3)C(=O)OC
CCOc1ccc2c(c1)sc(n2)SCc1cccc(c1)C(=O)OC
InChI=1SC18H17NO3S2c132214781516(1014)2418(1915)23111254613(912)17(20)212h410H311H212H3
METHYL3(((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)METHYL)BENZOATE
methyl3(((6ethoxybenzo(d)thiazol2yl)thio)methyl)benzoate
METHYL3((6ETHOXY13BENZOTHIAZOL2YL)SULFANYLMETHYL)BENZOATE
METHYL3((6ETHOXYBENZOTHIAZOL2YLTHIO)METHYL)BENZOATE
MFCD01141223
STK079279
ZINC000001212000
ZINC01212000
ZINC1212000

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Available files

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