Vitas-M small molecule compound
2-{[3-(3-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK544508
SMILES O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)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 C32H31N3O2S MW 521.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O2S/c1-22-11-10-15-25(19-22)35-30(37)28-29(34-31(35)38-21-27(36)33-24-13-4-2-5-14-24)26-16-7-6-12-23(26)20-32(28)17-8-3-9-18-32/h2,4-7,10-16,19H,3,8-9,17-18,20-21H2,1H3,(H,33,36)InChIKey
DHTKUHGWLDZCJH-UHFFFAOYSA-NSynonyms
489403-30-72((3(3methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)Nphenylacetamide
2((4oxo3(mtolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)Nphenylacetamide
2(3(3METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNPHENYLACETAMIDE
489403307
CC1=CC(=CC=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC=CC=C6
InChI=1SC32H31N3O2Sc12211101525(1922)3530(37)2829(3431(35)382127(36)3324134251424)2616761223(26)2032(28)178391832h247101619H38917182021H21H3(H3336)
MFCD03296037
ZINC000001824153
ZINC01824153
ZINC1824153
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