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'-cyclopentan]-2-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK550780
SMILES O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3
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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 C28H29N3O2S MW 471.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O2S/c1-19(2)17-31-26(33)24-25(22-13-7-6-10-20(22)16-28(24)14-8-9-15-28)30-27(31)34-18-23(32)29-21-11-4-3-5-12-21/h3-7,10-13H,1,8-9,14-18H2,2H3,(H,29,32)InChIKey
QDENUOFQGJQXHV-UHFFFAOYSA-NSynonyms
836646-00-52((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)Nphenylacetamide
2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)Nphenylacetamide
2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNPHENYLACETAMIDE
836646005
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NC5=CC=CC=C5
InChI=1SC28H29N3O2Sc119(2)173126(33)2425(2213761020(22)1628(24)14891528)3027(31)341823(32)2921114351221h371013H1891418H22H3(H2932)
MFCD03691630
ZINC000002253334
ZINC02253334
ZINC2253334
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