Vitas-M small molecule compound
N,N-dibutyl-2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK548202
SMILES CCCCN(C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3)CCCC
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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 C31H43N3O2S MW 521.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H43N3O2S/c1-5-7-18-33(19-8-6-2)26(35)22-37-30-32-28-25-15-11-10-14-24(25)20-31(16-12-9-13-17-31)27(28)29(36)34(30)21-23(3)4/h10-11,14-15H,3,5-9,12-13,16-22H2,1-2,4H3InChIKey
HDUBYBXLYJCOJY-UHFFFAOYSA-NSynonyms
488852-04-6488852046
CCCCN(CCCC)C(=O)CSC1=NC2=C(C(=O)N1CC(=C)C)C3(CCCCC3)CC4=CC=CC=C42
InChI=1SC31H43N3O2Sc1571833(19862)26(35)2237303228251511101424(25)2031(16129131731)27(28)29(36)34(30)2123(3)4h10111415H35912131622H2124H3
MFCD03294681
NNdibutyl2((3(2methylallyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
NNdibutyl2((3(2methylprop2en1yl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
NNDIBUTYL2(3(2METHYLPROP2ENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000009272340
ZINC09272340
ZINC9272340
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