Vitas-M small molecule compound
9-chloro-2-(thiophen-2-yl)-5-(2,3,4-trimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL021273
SMILES COc1c(ccc(c1OC)OC)C1Oc2ccc(cc2C2N1N=C(C2)c1cccs1)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 C23H21ClN2O4S MW 456.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O4S/c1-27-19-9-7-14(21(28-2)22(19)29-3)23-26-17(12-16(25-26)20-5-4-10-31-20)15-11-13(24)6-8-18(15)30-23/h4-11,17,23H,12H2,1-3H3InChIKey
OIOJIFFFYFYUJF-UHFFFAOYSA-NSynonyms
1(2CHLORO9(2THIENYL)(6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL))234TRIMETHOXYBENZENE
9chloro2(thiophen2yl)5(234trimethoxyphenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9CHLORO2THIOPHEN2YL5(234TRIMETHOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
COC1=C(C(=C(C=C1)C2N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C=CC(=C5)Cl)OC)OC
InChI=1SC23H21ClN2O4Sc127199714(21(282)22(19)293)232617(1216(2526)2054103120)151113(24)6818(15)3023h4111723H12H213H3
MFCD05827202
ZINC000012196380
ZINC000012196396
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