Vitas-M small molecule compound

2-{[(4-tert-butylbenzyl)sulfanyl]methyl}-1H-benzimidazole

Catalog ID
STL482002
SMILES CC(c1ccc(cc1)CSCc1nc2c([nH]1)cccc2)(C)C

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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 C19H22N2S MW 310.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2S/c1-19(2,3)15-10-8-14(9-11-15)12-22-13-18-20-16-6-4-5-7-17(16)21-18/h4-11H,12-13H2,1-3H3,(H,20,21)
InChIKey
NTPDQNCVTCRXMF-UHFFFAOYSA-N
Synonyms

2(((4tertbutylbenzyl)sulfanyl)methyl)1Hbenzimidazole
2((4TERTBUTYLPHENYL)METHYLSULFANYLMETHYL)1HBENZIMIDAZOLE
BENZIMIDAZOL2YL((4(TERTBUTYL)PHENYL)METHYLTHIO)METHANE
CC(C)(C)C1=CC=C(C=C1)CSCC2=NC3=CC=CC=C3N2
CC(c1ccc(cc1)CSCc1nc2c((nH)1)cccc2)(C)C
InChI=1SC19H22N2Sc119(23)1510814(91115)122213182016645717(16)2118h411H1213H213H3(H2021)
MFCD03967288
ZINC000001473120
ZINC01473120
ZINC1473120

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Available files

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