Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Catalog ID
STK937216
SMILES O=C(Nc1cccc2c1cccc2)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3
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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 C36H33N3O2S MW 571.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H33N3O2S/c1-24-16-18-27(19-17-24)39-34(41)32-33(29-14-6-4-11-26(29)22-36(32)20-7-2-8-21-36)38-35(39)42-23-31(40)37-30-15-9-12-25-10-3-5-13-28(25)30/h3-6,9-19H,2,7-8,20-23H2,1H3,(H,37,40)InChIKey
RLFOUSAZLMSJEG-UHFFFAOYSA-NSynonyms
2((3(4methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(naphthalen1yl)acetamide
2(3(4METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNAPHTHALEN1YLACETAMIDE
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC=CC7=CC=CC=C76
InChI=1SC36H33N3O2Sc124161827(191724)3934(41)3233(2914641126(29)2236(32)207282136)3835(39)422331(40)3730159122510351328(25)30h36919H2782023H21H3(H3740)
MFCD03292124
N(naphthalen1yl)2((4oxo3(ptolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
ZINC000001765797
ZINC01765797
ZINC1765797
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