Vitas-M small molecule compound

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

Catalog ID
STK392037
SMILES Cc1ccc(cc1)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 C15H13NS2 MW 271.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NS2/c1-11-6-8-12(9-7-11)10-17-15-16-13-4-2-3-5-14(13)18-15/h2-9H,10H2,1H3
InChIKey
OUNODDYGLXFOHC-UHFFFAOYSA-N
Synonyms
100498-95-1
100498951
2((4methylbenzyl)sulfanyl)13benzothiazole
2((4METHYLPHENYL)METHYLSULFANYL)13BENZOTHIAZOLE
2((4METHYLPHENYL)METHYLTHIO)BENZOTHIAZOLE
2(4METHYLBENZYLTHIO)BENZOTHIAZOLE
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3S2
InChI=1SC15H13NS2c1116812(9711)1017151613423514(13)1815h29H10H21H3
MFCD00442856
ZINC000000036099
ZINC00036099
ZINC36099

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Available files

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