Vitas-M small molecule compound
1-benzyl-9'-chloro-2'-(thiophen-2-yl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STL022292
SMILES Clc1ccc2c(c1)C1CC(=NN1C1(O2)CCN(CC1)Cc1ccccc1)c1cccs1
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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 C25H24ClN3OS MW 450.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3OS/c26-19-8-9-23-20(15-19)22-16-21(24-7-4-14-31-24)27-29(22)25(30-23)10-12-28(13-11-25)17-18-5-2-1-3-6-18/h1-9,14-15,22H,10-13,16-17H2InChIKey
HWWKXTHNOXPQQY-UHFFFAOYSA-NSynonyms
1benzyl9chloro2(thiophen2yl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
1benzyl9chloro2thiophen2ylspiro(110bdihydropyrazolo(15c)(13)benzoxazine54piperidine)
2(2CHLORO14BENZYLSPIRO(10AHBENZO(E)2PYRAZOLINO(15C)13OXAZINE64PIPERIDINE)9YL)THIOPHENE
C1CN(CCC12N3C(CC(=N3)C4=CC=CS4)C5=C(O2)C=CC(=C5)Cl)CC6=CC=CC=C6
InChI=1SC25H24ClN3OSc2619892320(1519)221621(2474143124)2729(22)25(3023)101228(131125)17185213618h19141522H10131617H2
MFCD06640515
ZINC000008717721
ZINC000008717722
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