Vitas-M small molecule compound
2-[(4-tert-butylbenzyl)sulfanyl]-3-(3,4-dimethoxyphenyl)quinazolin-4(3H)-one
Catalog ID
STL107039
SMILES COc1ccc(cc1OC)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 C27H28N2O3S MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3S/c1-27(2,3)19-12-10-18(11-13-19)17-33-26-28-22-9-7-6-8-21(22)25(30)29(26)20-14-15-23(31-4)24(16-20)32-5/h6-16H,17H2,1-5H3InChIKey
UKSFQARDNIDVAF-UHFFFAOYSA-NSynonyms
2((4tertbutylbenzyl)sulfanyl)3(34dimethoxyphenyl)quinazolin4(3H)one
2((4tertbutylphenyl)methylsulfanyl)3(34dimethoxyphenyl)quinazolin4one
CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)OC)OC
InChI=1SC27H28N2O3Sc127(23)19121018(111319)1733262822976821(22)25(30)29(26)20141523(314)24(1620)325h616H17H215H3
MFCD05376098
ZINC000067260471
ZINC67260471
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