Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-phenylquinazolin-4(3H)-one
Catalog ID
STK735276
SMILES O=c1n(c2ccccc2)c(SCc2ccc3c(c2)OCO3)nc2c1cccc2
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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 C22H16N2O3S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O3S/c25-21-17-8-4-5-9-18(17)23-22(24(21)16-6-2-1-3-7-16)28-13-15-10-11-19-20(12-15)27-14-26-19/h1-12H,13-14H2InChIKey
XHOPLWLLWLADKW-UHFFFAOYSA-NSynonyms
2((13BENZODIOXOL5YLMETHYL)SULFANYL)3PHENYLQUINAZOLIN4(3H)ONE
2(13BENZODIOXOL5YLMETHYLSULFANYL)3PHENYLQUINAZOLIN4ONE
2(2HBENZO(34D)13DIOXOLEN5YLMETHYLTHIO)3PHENYL3HYDROQUINAZOLIN4ONE
C1OC2=C(O1)C=C(C=C2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5
InChI=1SC22H16N2O3Sc252117845918(17)2322(24(21)166213716)28131510111920(1215)27142619h112H1314H2
MFCD01418224
ZINC000000707143
ZINC00707143
ZINC707143
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