Vitas-M small molecule compound

methyl 4-[9-chloro-7-methoxy-2-(4-methylphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]benzoate

Catalog ID
STK740268
SMILES COc1cc(Cl)cc2c1OC(c1ccc(cc1)C(=O)OC)N1C2CC(=N1)c1ccc(cc1)C

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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 C26H23ClN2O4 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4/c1-15-4-6-16(7-5-15)21-14-22-20-12-19(27)13-23(31-2)24(20)33-25(29(22)28-21)17-8-10-18(11-9-17)26(30)32-3/h4-13,22,25H,14H2,1-3H3
InChIKey
KLRBYZQGHRKUEC-UHFFFAOYSA-N
Synonyms
840470-32-8
840470328
CC1=CC=C(C=C1)C2=NN3C(C2)C4=CC(=CC(=C4OC3C5=CC=C(C=C5)C(=O)OC)OC)Cl
InChI=1SC26H23ClN2O4c1154616(7515)211422201219(27)1323(312)24(20)3325(29(22)2821)1781018(11917)26(30)323h4132225H14H213H3
METHYL4(2CHLORO4METHOXY9(4METHYLPHENYL)6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL)BENZOATE
methyl4(9chloro7methoxy2(4methylphenyl)110bdihydropyrazolo(15c)(13)benzoxazin5yl)benzoate
METHYL4(9CHLORO7METHOXY2(4METHYLPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)BENZOATE
methyl4(9chloro7methoxy2(ptolyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)benzoate
MFCD04005120
ZINC000008766497
ZINC000013750518

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Available files

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