Vitas-M small molecule compound
9'-methyl-2'-(naphthalen-2-yl)-1-propyl-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK993474
SMILES CCCN1CCC2(CC1)Oc1ccc(cc1C1N2N=C(C1)c1ccc2c(c1)cccc2)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 C28H31N3O MW 425.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O/c1-3-14-30-15-12-28(13-16-30)31-26(24-17-20(2)8-11-27(24)32-28)19-25(29-31)23-10-9-21-6-4-5-7-22(21)18-23/h4-11,17-18,26H,3,12-16,19H2,1-2H3InChIKey
LGKRFJCIXFSLEJ-UHFFFAOYSA-NSynonyms
9methyl2(naphthalen2yl)1propyl110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
9methyl2naphthalen2yl1propylspiro(110bdihydropyrazolo(15c)(13)benzoxazine54piperidine)
CCCN1CCC2(CC1)N3C(CC(=N3)C4=CC5=CC=CC=C5C=C4)C6=C(O2)C=CC(=C6)C
InChI=1SC28H31N3Oc131430151228(131630)3126(241720(2)81127(24)3228)1925(2931)2310921645722(21)1823h411171826H3121619H212H3
MFCD18184879
ZINC000051329988
ZINC000051329990
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