Vitas-M small molecule compound

N-{2-[(4-tert-butyl-2,6-dimethylbenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-2-methylbenzamide

Catalog ID
STK119998
SMILES Cc1cc(cc(c1CSc1nc2c(s1)cc(cc2)NC(=O)c1ccccc1C)C)C(C)(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 C28H30N2OS2 MW 474.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2OS2/c1-17-9-7-8-10-22(17)26(31)29-21-11-12-24-25(15-21)33-27(30-24)32-16-23-18(2)13-20(14-19(23)3)28(4,5)6/h7-15H,16H2,1-6H3,(H,29,31)
InChIKey
MDKAKXBAFVJHTD-UHFFFAOYSA-N
Synonyms

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=C(C=C(C=C4C)C(C)(C)C)C
InChI=1SC28H30N2OS2c1179781022(17)26(31)292111122425(1521)3327(3024)32162318(2)1320(1419(23)3)28(45)6h715H16H216H3(H2931)
MFCD01580644
N(2((4TERTBUTYL26DIMETHYLBENZYL)SULFANYL)13BENZOTHIAZOL6YL)2METHYLBENZAMIDE
N(2((4TERTBUTYL26DIMETHYLPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)2METHYLBENZAMIDE
ZINC000012629821
ZINC12629821

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Available files

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