Vitas-M small molecule compound

2'-(3,4-dichlorophenyl)-7'-methoxy-2,2-dimethyl-1',2,3,5,6,10b'-hexahydrospiro[pyran-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK544751
SMILES COc1cccc2c1OC1(CCOC(C1)(C)C)N1C2CC(=N1)c1ccc(c(c1)Cl)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 C23H24Cl2N2O3 MW 447.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24Cl2N2O3/c1-22(2)13-23(9-10-29-22)27-19(15-5-4-6-20(28-3)21(15)30-23)12-18(26-27)14-7-8-16(24)17(25)11-14/h4-8,11,19H,9-10,12-13H2,1-3H3
InChIKey
WENAUEXWDPYYJE-UHFFFAOYSA-N
Synonyms
498537-03-4
2(34dichlorophenyl)7methoxy22dimethyl1235610bhexahydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54pyran)
2(34dichlorophenyl)7methoxy22dimethyl1235610bhexahydrospiro(pyran45pyrazolo(15c)(13)benzoxazine)
2(34DICHLOROPHENYL)7METHOXY22DIMETHYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54OXANE)
498537034
CC1(CC2(CCO1)N3C(CC(=N3)C4=CC(=C(C=C4)Cl)Cl)C5=C(O2)C(=CC=C5)OC)C
InChI=1SC23H24Cl2N2O3c122(2)1323(9102922)2719(1554620(283)21(15)3023)1218(2627)147816(24)17(25)1114h481119H9101213H213H3
MFCD03301756
ZINC000009044383
ZINC000102699668

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.