Vitas-M small molecule compound

2-{[3-(3-bromophenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide

Catalog ID
STK835741
SMILES NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)Br)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 C25H24BrN3O2S MW 510.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O2S/c26-17-8-6-9-18(13-17)29-23(31)21-22(28-24(29)32-15-20(27)30)19-10-3-2-7-16(19)14-25(21)11-4-1-5-12-25/h2-3,6-10,13H,1,4-5,11-12,14-15H2,(H2,27,30)
InChIKey
YRZSCBFJQWIZBO-UHFFFAOYSA-N
Synonyms

2((3(3bromophenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
2((3(3bromophenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
2(3(3BROMOPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)N)C5=CC(=CC=C5)Br
InChI=1SC25H24BrN3O2Sc261786918(1317)2923(31)2122(2824(29)321520(27)30)191032716(19)1425(21)114151225h2361013H14511121415H2(H22730)
MFCD02642369
ZINC000001817335
ZINC01817335
ZINC1817335

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Available files

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