Vitas-M small molecule compound
2-[(3-methylbenzyl)sulfanyl]-3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK550464
SMILES Cc1ccc(cc1)n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C32H32N2OS MW 492.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2OS/c1-22-13-15-26(16-14-22)34-30(35)28-29(33-31(34)36-21-24-10-8-9-23(2)19-24)27-12-5-4-11-25(27)20-32(28)17-6-3-7-18-32/h4-5,8-16,19H,3,6-7,17-18,20-21H2,1-2H3InChIKey
RWCFTRKQWRJCDG-UHFFFAOYSA-NSynonyms
799800-72-92((3methylbenzyl)sulfanyl)3(4methylphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((3methylbenzyl)thio)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHYLPHENYL)2((3METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799800729
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=CC=CC(=C6)C
InChI=1SC32H32N2OSc122131526(161422)3430(35)2829(3331(34)362124108923(2)1924)2712541125(27)2032(28)176371832h4581619H36717182021H212H3
MFCD03678366
ZINC000002223366
ZINC02223366
ZINC2223366
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