Vitas-M small molecule compound
3-butyl-2-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK545155
SMILES CCCCn1c(SCC(=O)N2CCCCC2)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 C28H37N3O2S MW 479.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O2S/c1-2-3-18-31-26(33)24-25(29-27(31)34-20-23(32)30-16-10-5-11-17-30)22-13-7-6-12-21(22)19-28(24)14-8-4-9-15-28/h6-7,12-13H,2-5,8-11,14-20H2,1H3InChIKey
YACQIPSFVXFKPU-UHFFFAOYSA-NSynonyms
498571-64-53butyl2((2oxo2(piperidin1yl)ethyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2((2oxo2(piperidin1yl)ethyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2(2OXO2PIPERIDIN1YLETHYL)SULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
498571645
CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)N5CCCCC5
InChI=1SC28H37N3O2Sc123183126(33)2425(2927(31)342023(32)3016105111730)2213761221(22)1928(24)148491528h671213H258111420H21H3
MFCD03302266
ZINC000002351170
ZINC02351170
ZINC2351170
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