Vitas-M small molecule compound
2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-dipropylacetamide
Catalog ID
STK548105
SMILES CCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CCC
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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 C29H39N3O2S MW 493.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H39N3O2S/c1-5-16-31(17-6-2)24(33)20-35-28-30-26-23-13-9-8-12-22(23)18-29(14-10-7-11-15-29)25(26)27(34)32(28)19-21(3)4/h8-9,12-13H,3,5-7,10-11,14-20H2,1-2,4H3InChIKey
CLDWZGFLDGGOGI-UHFFFAOYSA-NSynonyms
497079-77-32((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)NNdipropylacetamide
2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)NNdipropylacetamide
2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNDIPROPYLACETAMIDE
497079773
CCCN(CCC)C(=O)CSC1=NC2=C(C(=O)N1CC(=C)C)C3(CCCCC3)CC4=CC=CC=C42
InChI=1SC29H39N3O2Sc151631(1762)24(33)20352830262313981222(23)1829(14107111529)25(26)27(34)32(28)1921(3)4h891213H35710111420H2124H3
MFCD03299554
ZINC000002318715
ZINC02318715
ZINC2318715
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