Vitas-M small molecule compound
4-phenyl-2'-[4-(phenylsulfanyl)phenyl]-1',10b'-dihydrospiro[cyclohexane-1,5'-pyrazolo[1,5-c][1,3]benzoxazine]
Catalog ID
STK541562
SMILES c1ccc(cc1)Sc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC12CCC(CC1)c1ccccc1
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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 C33H30N2OS MW 502.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2OS/c1-3-9-24(10-4-1)25-19-21-33(22-20-25)35-31(29-13-7-8-14-32(29)36-33)23-30(34-35)26-15-17-28(18-16-26)37-27-11-5-2-6-12-27/h1-18,25,31H,19-23H2InChIKey
ZOHWYGVJMYNKHX-UHFFFAOYSA-NSynonyms
956241-48-84phenyl2(4(phenylsulfanyl)phenyl)110bdihydrospiro(cyclohexane15pyrazolo(15c)(13)benzoxazine)
4phenyl2(4(phenylthio)phenyl)110bdihydrospiro(benzo(e)pyrazolo(15c)(13)oxazine51cyclohexane)
4PHENYL2(4PHENYLSULFANYLPHENYL)SPIRO(110BDIHYDROPYRAZOLO(15C)(13)BENZOXAZINE51CYCLOHEXANE)
956241488
C1CC2(CCC1C3=CC=CC=C3)N4C(CC(=N4)C5=CC=C(C=C5)SC6=CC=CC=C6)C7=CC=CC=C7O2
InChI=1SC33H30N2OSc13924(1041)25192133(222025)3531(2913781432(29)3633)2330(3435)26151728(181626)3727115261227h1182531H1923H2
MFCD03292903
ZINC000009065588
ZINC000009065591
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