Vitas-M small molecule compound
4-{(4Z)-7,7-dimethyl-4-[(2-methylphenyl)imino]-2-sulfanyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK559761
SMILES Cc1ccccc1/N=C/1\N=C(N(C21CCOC(C2)(C)C)c1c(C)n(n(c1=O)c1ccccc1)C)S
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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 C27H31N5O2S MW 489.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O2S/c1-18-11-9-10-14-21(18)28-24-27(15-16-34-26(3,4)17-27)31(25(35)29-24)22-19(2)30(5)32(23(22)33)20-12-7-6-8-13-20/h6-14H,15-17H2,1-5H3,(H,28,29,35)InChIKey
YYXBURMPWJFCOX-UHFFFAOYSA-NSynonyms
577985-71-84((4Z)77dimethyl4((2methylphenyl)imino)2sulfanyl8oxa13diazaspiro(45)dec2en1yl)15dimethyl2phenyl12dihydro3Hpyrazol3one
4(77DIMETHYL4((2METHYLPHENYL)AMINO)2THIOXO8OXA13DIAZASPIRO(45)DEC3EN1YL)15DIMETHYL2PHENYL12DIHYDRO3HPYRAZOL3ONE
4(77dimethyl4(2methylanilino)2sulfanylidene8oxa13diazaspiro(45)dec3en1yl)15dimethyl2phenylpyrazol3one
4(99DIMETHYL1(2METHYLANILINO)3SULFANYLIDENE8OXA24DIAZASPIRO(45)DEC1EN4YL)15DIMETHYL2PHENYLPYRAZOL3ONE
577985718
CC1=CC=CC=C1NC2=NC(=S)N(C23CCOC(C3)(C)C)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
Cc1ccccc1N=C1N=C(N(C21CCOC(C2)(C)C)c1c(C)n(n(c1=O)c1ccccc1)C)S
InChI=1SC27H31N5O2Sc118119101421(18)282427(15163426(34)1727)31(25(35)2924)2219(2)30(5)32(23(22)33)20127681320h614H1517H215H3(H282935)
MFCD04074113
ZINC000013748406
ZINC000017194976
Check stock
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