Vitas-M small molecule compound
N-(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)-2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK531807
SMILES N#CC1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2Cc2ccco2)CCCCC4)c2ccccc2CC21CCCCC2
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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 C40H40N4O3S MW 656.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H40N4O3S/c41-24-32-35(30-15-5-3-12-27(30)22-39(32)17-7-1-8-18-39)42-33(45)26-48-38-43-36-31-16-6-4-13-28(31)23-40(19-9-2-10-20-40)34(36)37(46)44(38)25-29-14-11-21-47-29/h3-6,11-16,21H,1-2,7-10,17-20,22-23,25-26H2,(H,42,45)InChIKey
WJVFIMKHTRVPPV-UHFFFAOYSA-NSynonyms
C1CCC2(CC1)CC3=CC=CC=C3C(=C2C#N)NC(=O)CSC4=NC5=C(C(=O)N4CC6=CC=CO6)C7(CCCCC7)CC8=CC=CC=C85
InChI=1SC40H40N4O3Sc41243235(3015531227(30)2239(32)177181839)4233(45)26483843363116641328(31)2340(1992102040)34(36)37(46)44(38)25291411214729h36111621H12710172022232526H2(H4245)
MFCD02998063
N(2CYANOSPIRO(4HNAPHTHALENE31CYCLOHEXANE)1YL)2(3(FURAN2YLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
N(3cyano1Hspiro(cyclohexane12naphthalen)4yl)2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3cyano1Hspiro(cyclohexane12naphthalen)4yl)2((3(furan2ylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
ZINC000150404824
ZINC150404824
Check stock
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