Vitas-M small molecule compound
N-benzyl-2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK936053
SMILES O=C(CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)C)CCCCC3)NCc1ccccc1
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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 C33H33N3O2S MW 535.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O2S/c1-23-11-10-15-26(19-23)36-31(38)29-30(27-16-7-6-14-25(27)20-33(29)17-8-3-9-18-33)35-32(36)39-22-28(37)34-21-24-12-4-2-5-13-24/h2,4-7,10-16,19H,3,8-9,17-18,20-22H2,1H3,(H,34,37)InChIKey
QGZBHMQUDDVVPK-UHFFFAOYSA-NSynonyms
487033-20-5487033205
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NCC6=CC=CC=C6
InChI=1SC33H33N3O2Sc12311101526(1923)3631(38)2930(2716761425(27)2033(29)178391833)3532(36)392228(37)342124124251324h247101619H38917182022H21H3(H3437)
MFCD03287089
Nbenzyl2((3(3methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
Nbenzyl2((4oxo3(mtolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
NBENZYL2(3(3METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001819367
ZINC01819367
ZINC1819367
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