Vitas-M small molecule compound

2-[(4-tert-butylbenzyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one

Catalog ID
STL106397
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)C(C)(C)C)nc2c(c1=O)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 C26H26N2O2S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S/c1-26(2,3)19-11-9-18(10-12-19)17-31-25-27-23-8-6-5-7-22(23)24(29)28(25)20-13-15-21(30-4)16-14-20/h5-16H,17H2,1-4H3
InChIKey
XUWMUJWGPXVSRM-UHFFFAOYSA-N
Synonyms

2((4(TERTBUTYL)PHENYL)METHYLTHIO)3(4METHOXYPHENYL)3HYDROQUINAZOLIN4ONE
2((4tertbutylbenzyl)sulfanyl)3(4methoxyphenyl)quinazolin4(3H)one
2((4tertbutylphenyl)methylsulfanyl)3(4methoxyphenyl)quinazolin4one
CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC
InChI=1SC26H26N2O2Sc126(23)1911918(101219)1731252723865722(23)24(29)28(25)20131521(304)161420h516H17H214H3
MFCD03473493
ZINC000028380843
ZINC28380843

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Available files

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