Vitas-M small molecule compound
7-ethoxy-2-(4-ethoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL021229
SMILES CCOc1cccc2c1OC(c1ccc(cc1)SC)N1C2CC(=N1)c1ccc(cc1)OCC
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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 C27H28N2O3S MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3S/c1-4-30-20-13-9-18(10-14-20)23-17-24-22-7-6-8-25(31-5-2)26(22)32-27(29(24)28-23)19-11-15-21(33-3)16-12-19/h6-16,24,27H,4-5,17H2,1-3H3InChIKey
QIVYFRQHMUNRRE-UHFFFAOYSA-NSynonyms
4ETHOXY1(4ETHOXY6(4METHYLTHIOPHENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN9YL))BENZENE
7ethoxy2(4ethoxyphenyl)5(4(methylsulfanyl)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
7ETHOXY2(4ETHOXYPHENYL)5(4METHYLSULFANYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCOC1=CC=C(C=C1)C2=NN3C(C2)C4=C(C(=CC=C4)OCC)OC3C5=CC=C(C=C5)SC
InChI=1SC27H28N2O3Sc14302013918(101420)2317242276825(3152)26(22)3227(29(24)2823)19111521(333)161219h6162427H4517H213H3
MFCD05827170
ZINC000012196011
ZINC000248380530
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