Vitas-M small molecule compound
N-(3'-cyano-1'H-spiro[cyclopentane-1,2'-naphthalen]-4'-yl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK532196
SMILES N#CC1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2OC)CCCCC4)c2ccccc2CC21CCCC2
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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 C41H40N4O3S MW 668.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H40N4O3S/c1-48-33-18-8-7-17-32(33)45-38(47)35-37(30-16-6-4-14-28(30)24-41(35)21-9-2-10-22-41)44-39(45)49-26-34(46)43-36-29-15-5-3-13-27(29)23-40(31(36)25-42)19-11-12-20-40/h3-8,13-18H,2,9-12,19-24,26H2,1H3,(H,43,46)InChIKey
PLMLHXITLQXVQQ-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=C(C7(CCCC7)CC8=CC=CC=C86)C#N
InChI=1SC41H40N4O3Sc1483318871732(33)4538(47)3537(3016641428(30)2441(35)2192102241)4439(45)492634(46)43362915531327(29)2340(31(36)2542)1911122040h381318H2912192426H21H3(H4346)
MFCD02990867
N(2CYANOSPIRO(4HNAPHTHALENE31CYCLOPENTANE)1YL)2(3(2METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
N(3cyano1Hspiro(cyclopentane12naphthalen)4yl)2((3(2methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3cyano1Hspiro(cyclopentane12naphthalen)4yl)2((3(2methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
ZINC000150412570
ZINC150412570
Check stock
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