Vitas-M small molecule compound
3-benzyl-2-{[4-methoxy-2-methyl-5-(propan-2-yl)benzyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STK664946
SMILES COc1cc(C)c(cc1C(C)C)CSc1nc2ccccc2c(=O)n1Cc1ccccc1
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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 C27H28N2O2S MW 444.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O2S/c1-18(2)23-15-21(19(3)14-25(23)31-4)17-32-27-28-24-13-9-8-12-22(24)26(30)29(27)16-20-10-6-5-7-11-20/h5-15,18H,16-17H2,1-4H3InChIKey
JCZCIEOAGQDLQP-UHFFFAOYSA-NSynonyms
3benzyl2((4methoxy2methyl5(propan2yl)benzyl)sulfanyl)quinazolin4(3H)one
3BENZYL2((4METHOXY2METHYL5PROPAN2YLPHENYL)METHYLSULFANYL)QUINAZOLIN4ONE
CC1=CC(=C(C=C1CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(C)C)OC
InChI=1SC27H28N2O2Sc118(2)231521(19(3)1425(23)314)173227282413981222(24)26(30)29(27)1620106571120h51518H1617H214H3
MFCD07658301
ZINC000012445191
ZINC12445191
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