Vitas-M small molecule compound
N-benzyl-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl]sulfanyl}acetamide
Catalog ID
STK552816
SMILES O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCC3)NCc1ccccc1
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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 C29H31N3O2S MW 485.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O2S/c1-20(2)18-32-27(34)25-26(23-13-7-6-12-22(23)16-29(25)14-8-9-15-29)31-28(32)35-19-24(33)30-17-21-10-4-3-5-11-21/h3-7,10-13H,1,8-9,14-19H2,2H3,(H,30,33)InChIKey
ZRQVNPFONFQGAO-UHFFFAOYSA-NSynonyms
839704-44-8839704448
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)NCC5=CC=CC=C5
InChI=1SC29H31N3O2Sc120(2)183227(34)2526(2313761222(23)1629(25)14891529)3128(32)351924(33)301721104351121h371013H1891419H22H3(H3033)
MFCD03693688
Nbenzyl2((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetamide
Nbenzyl2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetamide
NBENZYL2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETAMIDE
ZINC000002256034
ZINC02256034
ZINC2256034
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