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-(4-methoxyphenyl)acetamide
Catalog ID
STK552808
SMILES COc1ccc(cc1)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC)CCCCC3
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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 C28H31N3O3S MW 489.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O3S/c1-3-31-26(33)24-25(22-10-6-5-9-19(22)17-28(24)15-7-4-8-16-28)30-27(31)35-18-23(32)29-20-11-13-21(34-2)14-12-20/h5-6,9-14H,3-4,7-8,15-18H2,1-2H3,(H,29,32)InChIKey
RHXDOPZPNWALPV-UHFFFAOYSA-NSynonyms
836633-29-52((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(4methoxyphenyl)acetamide
2((3ethyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(4methoxyphenyl)acetamide
2(3ETHYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(4METHOXYPHENYL)ACETAMIDE
836633295
CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=CC=C(C=C5)OC
InChI=1SC28H31N3O3Sc133126(33)2425(221065919(22)1728(24)157481628)3027(31)351823(32)2920111321(342)141220h56914H34781518H212H3(H2932)
MFCD03689201
ZINC000009461914
ZINC09461914
ZINC9461914
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