Vitas-M small molecule compound
2-(thiophen-2-yl)-5-(2,4,5-trimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK521280
SMILES COc1cc(OC)c(cc1C1Oc2ccccc2C2N1N=C(C2)c1cccs1)OC
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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 C23H22N2O4S MW 422.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4S/c1-26-19-13-21(28-3)20(27-2)11-15(19)23-25-17(14-7-4-5-8-18(14)29-23)12-16(24-25)22-9-6-10-30-22/h4-11,13,17,23H,12H2,1-3H3InChIKey
LHZSDJAGDKHODQ-UHFFFAOYSA-NSynonyms
2(thiophen2yl)5(245trimethoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
2THIOPHEN2YL5(245TRIMETHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
COC1=CC(=C(C=C1C2N3C(CC(=N3)C4=CC=CS4)C5=CC=CC=C5O2)OC)OC
InChI=1SC23H22N2O4Sc126191321(283)20(272)1115(19)232517(14745818(14)2923)1216(2425)2296103022h411131723H12H213H3
MFCD04230795
ZINC000009731267
ZINC000015016169
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