Vitas-M small molecule compound
[(3-methyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetonitrile
Catalog ID
STK805603
SMILES N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1C)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 C20H21N3OS MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3OS/c1-23-18(24)16-17(22-19(23)25-12-11-21)15-8-4-3-7-14(15)13-20(16)9-5-2-6-10-20/h3-4,7-8H,2,5-6,9-10,12-13H2,1H3InChIKey
BWFYBPCGDRGUSQ-UHFFFAOYSA-NSynonyms
328068-36-6((3methyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetonitrile
2((3methyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetonitrile
2(3METHYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETONITRILE
328068366
CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC#N
InChI=1SC20H21N3OSc12318(24)1617(2219(23)25121121)15843714(15)1320(16)95261020h3478H2569101213H21H3
MFCD01174968
ZINC000001799150
ZINC01799150
ZINC1799150
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