Vitas-M small molecule compound
3-[2-(4-chloro-1H-pyrazol-1-yl)ethyl]-2-[(3-nitrobenzyl)sulfanyl]quinazolin-4(3H)-one
Catalog ID
STK314316
SMILES Clc1cnn(c1)CCn1c(SCc2cccc(c2)[N+](=O)[O-])nc2c(c1=O)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 C20H16ClN5O3S MW 441.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O3S/c21-15-11-22-24(12-15)8-9-25-19(27)17-6-1-2-7-18(17)23-20(25)30-13-14-4-3-5-16(10-14)26(28)29/h1-7,10-12H,8-9,13H2InChIKey
PTEJOQMKUONORK-UHFFFAOYSA-NSynonyms
1005643-37-71005643377
3(2(4chloro1Hpyrazol1yl)ethyl)2((3nitrobenzyl)sulfanyl)quinazolin4(3H)one
3(2(4chloropyrazol1yl)ethyl)2((3nitrophenyl)methylsulfanyl)quinazolin4one
C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)(N+)(=O)(O))CCN4C=C(C=N4)Cl
Clc1cnn(c1)CCn1c(SCc2cccc(c2)(N+)(=O)(O))nc2c(c1=O)cccc2
InChI=1SC20H16ClN5O3Sc2115112224(1215)892519(27)17612718(17)2320(25)30131443516(1014)26(28)29h171012H8913H2
MFCD05667683
ZINC000002733737
ZINC02733737
ZINC2733737
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