Vitas-M small molecule compound
2-{[3-(3-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL060281
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nc2ccccc2c(=O)n1Cc1cccc(c1)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 C25H20ClN3O4S MW 493.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN3O4S/c26-17-5-3-4-16(12-17)14-29-24(31)19-6-1-2-7-20(19)28-25(29)34-15-23(30)27-18-8-9-21-22(13-18)33-11-10-32-21/h1-9,12-13H,10-11,14-15H2,(H,27,30)InChIKey
PUYOCWQYWMYKAV-UHFFFAOYSA-NSynonyms
2((3(3chlorobenzyl)4oxo34dihydroquinazolin2yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2(3((3chlorophenyl)methyl)4oxoquinazolin2yl)sulfanylN(23dihydro14benzodioxin6yl)acetamide
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC(=CC=C5)Cl
InChI=1SC25H20ClN3O4Sc261753416(1217)142924(31)19612720(19)2825(29)341523(30)2718892122(1318)3311103221h191213H10111415H2(H2730)
MFCD18193519
ZINC000067689404
ZINC67689404
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