Vitas-M small molecule compound
2-{[3-(4-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STL060395
SMILES O=C(Nc1ccc(c(c1)C)C)CSc1nc2ccccc2c(=O)n1Cc1ccc(cc1)Cl
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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 C25H22ClN3O2S MW 463.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O2S/c1-16-7-12-20(13-17(16)2)27-23(30)15-32-25-28-22-6-4-3-5-21(22)24(31)29(25)14-18-8-10-19(26)11-9-18/h3-13H,14-15H2,1-2H3,(H,27,30)InChIKey
VXKRGVTXKKQSAG-UHFFFAOYSA-NSynonyms
2((3(4chlorobenzyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(34dimethylphenyl)acetamide
2(3((4chlorophenyl)methyl)4oxoquinazolin2yl)sulfanylN(34dimethylphenyl)acetamide
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)Cl)C
InChI=1SC25H22ClN3O2Sc11671220(1317(16)2)2723(30)1532252822643521(22)24(31)29(25)141881019(26)11918h313H1415H212H3(H2730)
MFCD05386455
ZINC000057472814
ZINC57472814
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