Vitas-M small molecule compound
1-methyl-2'-[4-(phenylsulfanyl)phenyl]-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK532832
SMILES CN1CCC2(CC1)Oc1ccccc1C1N2N=C(C1)c1ccc(cc1)Sc1ccccc1
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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 C27H27N3OS MW 441.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3OS/c1-29-17-15-27(16-18-29)30-25(23-9-5-6-10-26(23)31-27)19-24(28-30)20-11-13-22(14-12-20)32-21-7-3-2-4-8-21/h2-14,25H,15-19H2,1H3InChIKey
RYFKASGSSBNVOZ-UHFFFAOYSA-NSynonyms
1methyl2(4(phenylsulfanyl)phenyl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
1methyl2(4(phenylthio)phenyl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
1METHYL2(4PHENYLSULFANYLPHENYL)SPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
CN1CCC2(CC1)N3C(CC(=N3)C4=CC=C(C=C4)SC5=CC=CC=C5)C6=CC=CC=C6O2
InChI=1SC27H27N3OSc129171527(161829)3025(239561026(23)3127)1924(2830)20111322(141220)32217324821h21425H1519H21H3
MFCD02239418
ZINC000009044409
ZINC000009044412
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