Vitas-M small molecule compound
2-[(3-ethyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
Catalog ID
STK549189
SMILES CCn1c(SCC(=O)Nc2ccccc2C)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 C28H31N3O2S MW 473.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2S/c1-3-31-26(33)24-25(21-13-7-6-12-20(21)17-28(24)15-9-4-10-16-28)30-27(31)34-18-23(32)29-22-14-8-5-11-19(22)2/h5-8,11-14H,3-4,9-10,15-18H2,1-2H3,(H,29,32)InChIKey
XTXWDVBLQXIZCX-UHFFFAOYSA-NSynonyms
839704-24-42((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(2methylphenyl)acetamide
2((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(otolyl)acetamide
2(3ETHYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(2METHYLPHENYL)ACETAMIDE
839704244
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=CC=C5C
InChI=1SC28H31N3O2Sc133126(33)2425(2113761220(21)1728(24)1594101628)3027(31)341823(32)292214851119(22)2h581114H349101518H212H3(H2932)
MFCD03693638
ZINC000002255983
ZINC02255983
ZINC2255983
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