Vitas-M small molecule compound

2'-(2,5-dimethylphenyl)-7'-methoxy-1-(methylsulfonyl)-1',10b'-dihydrospiro[piperidine-4,5'-pyrazolo[1,5-c][1,3]benzoxazine]

Catalog ID
STK993432
SMILES COc1cccc2c1OC1(CCN(CC1)S(=O)(=O)C)N1C2CC(=N1)c1cc(C)ccc1C

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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 C24H29N3O4S MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O4S/c1-16-8-9-17(2)19(14-16)20-15-21-18-6-5-7-22(30-3)23(18)31-24(27(21)25-20)10-12-26(13-11-24)32(4,28)29/h5-9,14,21H,10-13,15H2,1-4H3
InChIKey
ODRCSXKOOVOTBW-UHFFFAOYSA-N
Synonyms
850236-85-0
2(25dimethylphenyl)7methoxy1(methylsulfonyl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine54piperidine)
2(25dimethylphenyl)7methoxy1(methylsulfonyl)110bdihydrospiro(piperidine45pyrazolo(15c)(13)benzoxazine)
2(25DIMETHYLPHENYL)7METHOXY1METHYLSULFONYLSPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE54PIPERIDINE)
850236850
CC1=CC(=C(C=C1)C)C2=NN3C(C2)C4=C(C(=CC=C4)OC)OC35CCN(CC5)S(=O)(=O)C
InChI=1SC24H29N3O4Sc1168917(2)19(1416)2015211865722(303)23(18)3124(27(21)2520)101226(131124)32(428)29h591421H101315H214H3
MFCD05691625
ZINC000009320529
ZINC000009320530

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Available files

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