Vitas-M small molecule compound
2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK549637
SMILES O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)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 C29H27N3O3S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3S/c33-24(30-21-10-2-1-3-11-21)19-36-28-31-26-23-13-5-4-9-20(23)17-29(14-6-7-15-29)25(26)27(34)32(28)18-22-12-8-16-35-22/h1-5,8-13,16H,6-7,14-15,17-19H2,(H,30,33)InChIKey
XERGHXKZZLWLNY-UHFFFAOYSA-NSynonyms
836638-39-22((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)Nphenylacetamide
2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)Nphenylacetamide
2(3(FURAN2YLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNPHENYLACETAMIDE
836638392
C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)NC5=CC=CC=C5)CC6=CC=CO6
InChI=1SC29H27N3O3Sc3324(3021102131121)1936283126231354920(23)1729(14671529)25(26)27(34)32(28)1822128163522h1581316H6714151719H2(H3033)
MFCD03690111
ZINC000009462386
ZINC09462386
ZINC9462386
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