Vitas-M small molecule compound
N-benzyl-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK930154
SMILES COc1ccc(cc1)n1c(SCC(=O)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C33H33N3O3S MW 551.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O3S/c1-39-26-16-14-25(15-17-26)36-31(38)29-30(27-13-7-6-12-24(27)20-33(29)18-8-3-9-19-33)35-32(36)40-22-28(37)34-21-23-10-4-2-5-11-23/h2,4-7,10-17H,3,8-9,18-22H2,1H3,(H,34,37)InChIKey
UGVSOCDJRMASNJ-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NCC6=CC=CC=C6
InChI=1SC33H33N3O3Sc13926161425(151726)3631(38)2930(2713761224(27)2033(29)188391933)3532(36)402228(37)342123104251123h2471017H3891822H21H3(H3437)
MFCD03301486
Nbenzyl2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
Nbenzyl2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
NBENZYL2(3(4METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001822474
ZINC01822474
ZINC1822474
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