Vitas-M small molecule compound
3-benzyl-2-{[2-(2,5-dimethoxyphenyl)-2-oxoethyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STK113377
SMILES COc1ccc(c(c1)C(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1)OC
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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 C25H22N2O4S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4S/c1-30-18-12-13-23(31-2)20(14-18)22(28)16-32-25-26-21-11-7-6-10-19(21)24(29)27(25)15-17-8-4-3-5-9-17/h3-14H,15-16H2,1-2H3InChIKey
HCIZDTCHEGPTPI-UHFFFAOYSA-NSynonyms
3BENZYL2((2(25DIMETHOXYPHENYL)2OXOETHYL)SULFANYL)QUINAZOLIN4(3H)ONE
3BENZYL2(2(25DIMETHOXYPHENYL)2OXOETHYL)SULFANYLQUINAZOLIN4ONE
COC1=CC(=C(C=C1)OC)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4
InChI=1SC25H22N2O4Sc13018121323(312)20(1418)22(28)163225262111761019(21)24(29)27(25)15178435917h314H1516H212H3
MFCD03196993
ZINC000009763581
ZINC09763581
ZINC9763581
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