Vitas-M small molecule compound
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STK556673
SMILES O=C(Nc1nccs1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C29H28N4O2S2 MW 528.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O2S2/c34-23(31-27-30-15-16-36-27)19-37-28-32-25-22-12-6-5-11-21(22)17-29(13-7-2-8-14-29)24(25)26(35)33(28)18-20-9-3-1-4-10-20/h1,3-6,9-12,15-16H,2,7-8,13-14,17-19H2,(H,30,31,34)InChIKey
BWOXFMLZBLZKSW-UHFFFAOYSA-NSynonyms
573931-44-92((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(13thiazol2yl)acetamide
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(thiazol2yl)acetamide
2(3BENZYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(13THIAZOL2YL)ACETAMIDE
573931449
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)NC5=NC=CS5)CC6=CC=CC=C6
InChI=1SC29H28N4O2S2c3423(31273015163627)19372832252212651121(22)1729(137281429)24(25)26(35)33(28)182093141020h1369121516H27813141719H2(H303134)
MFCD04019625
ZINC000002195107
ZINC2195107
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