Vitas-M small molecule compound
2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK565626
SMILES COc1cccc(c1)n1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C33H30F3N3O3S MW 605.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30F3N3O3S/c1-42-25-13-8-12-24(18-25)39-30(41)28-29(26-14-4-3-9-21(26)19-32(28)15-5-2-6-16-32)38-31(39)43-20-27(40)37-23-11-7-10-22(17-23)33(34,35)36/h3-4,7-14,17-18H,2,5-6,15-16,19-20H2,1H3,(H,37,40)InChIKey
JGBFVIWGCAZTTR-UHFFFAOYSA-NSynonyms
2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(3(trifluoromethyl)phenyl)acetamide
2(3(3METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC=CC(=C6)C(F)(F)F
InChI=1SC33H30F3N3O3Sc142251381224(1825)3930(41)2829(261443921(26)1932(28)155261632)3831(39)432027(40)37231171022(1723)33(3435)36h347141718H25615161920H21H3(H3740)
MFCD04081665
ZINC000102536374
ZINC102536374
Check stock
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Check stock on Vitas-MAvailable files
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