Vitas-M small molecule compound
{[3-(cyclopentylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetonitrile
Catalog ID
STK832948
SMILES N#CCSc1nc2c3ccccc3CC3(c2c(=O)n1CC1CCCC1)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 C25H29N3OS MW 419.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3OS/c26-14-15-30-24-27-22-20-11-5-4-10-19(20)16-25(12-6-1-7-13-25)21(22)23(29)28(24)17-18-8-2-3-9-18/h4-5,10-11,18H,1-3,6-9,12-13,15-17H2InChIKey
WIHPTGMTQBVUBZ-UHFFFAOYSA-NSynonyms
332024-42-7((3(cyclopentylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetonitrile
2((3(cyclopentylmethyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetonitrile
2(3(CYCLOPENTYLMETHYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETONITRILE
332024427
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC#N)CC5CCCC5
InChI=1SC25H29N3OSc261415302427222011541019(20)1625(126171325)21(22)23(29)28(24)1718823918h45101118H136912131517H2
MFCD01174963
ZINC000002117647
ZINC02117647
ZINC2117647
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