Vitas-M small molecule compound

2-{[(4-hydroxyquinazolin-2-yl)methyl]sulfanyl}-1-[4-(methylsulfonyl)piperazin-1-yl]ethanone

Catalog ID
STK939288
SMILES O=C(N1CCN(CC1)S(=O)(=O)C)CSCc1nc(O)c2c(n1)cccc2

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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 C16H20N4O4S2 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O4S2/c1-26(23,24)20-8-6-19(7-9-20)15(21)11-25-10-14-17-13-5-3-2-4-12(13)16(22)18-14/h2-5H,6-11H2,1H3,(H,17,18,22)
InChIKey
DFCDKPILFJZKTH-UHFFFAOYSA-N
Synonyms
1179467-68-5
1179467685
2(((4hydroxyquinazolin2yl)methyl)sulfanyl)1(4(methylsulfonyl)piperazin1yl)ethanone
2((2(4methylsulfonylpiperazin1yl)2oxoethyl)sulfanylmethyl)1Hquinazolin4one
CS(=O)(=O)N1CCN(CC1)C(=O)CSCC2=NC(=O)C3=CC=CC=C3N2
InChI=1SC16H20N4O4S2c126(2324)208619(7920)15(21)112510141713532412(13)16(22)1814h25H611H21H3(H171822)
MFCD18179210
ZINC000035686419
ZINC35686419

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.