Vitas-M small molecule compound
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-[(4-methoxybenzyl)sulfanyl]quinazolin-4(3H)-one
Catalog ID
STK314375
SMILES COc1ccc(cc1)CSc1nc2ccccc2c(=O)n1CCn1ncc(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 C21H19ClN4O2S MW 426.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S/c1-28-17-8-6-15(7-9-17)14-29-21-24-19-5-3-2-4-18(19)20(27)26(21)11-10-25-13-16(22)12-23-25/h2-9,12-13H,10-11,14H2,1H3InChIKey
AQGNJAZGELVZRX-UHFFFAOYSA-NSynonyms
1005589-59-21005589592
3(2(4chloro1Hpyrazol1yl)ethyl)2((4methoxybenzyl)sulfanyl)quinazolin4(3H)one
3(2(4chloropyrazol1yl)ethyl)2((4methoxyphenyl)methylsulfanyl)quinazolin4one
COC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CCN4C=C(C=N4)Cl
InChI=1SC21H19ClN4O2Sc128178615(7917)1429212419532418(19)20(27)26(21)1110251316(22)122325h291213H101114H21H3
MFCD05667795
ZINC000002733877
ZINC02733877
ZINC2733877
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