Vitas-M small molecule compound

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

Catalog ID
STK700342
SMILES N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCC3

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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 C25H23N3O2S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O2S/c1-30-19-10-8-18(9-11-19)28-23(29)21-22(27-24(28)31-15-14-26)20-7-3-2-6-17(20)16-25(21)12-4-5-13-25/h2-3,6-11H,4-5,12-13,15-16H2,1H3
InChIKey
QHPGLAARGSVSBV-UHFFFAOYSA-N
Synonyms
312513-66-9
((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)acetonitrile
2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)acetonitrile
2(3(4METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLACETONITRILE
312513669
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC#N
InChI=1SC25H23N3O2Sc1301910818(91119)2823(29)2122(2724(28)31151426)20732617(20)1625(21)12451325h23611H4512131516H21H3
MFCD01174966
ZINC000001817118
ZINC01817118
ZINC1817118

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Available files

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