Vitas-M small molecule compound
3-(2-phenylethyl)-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK805027
SMILES CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)CCCCC3)C
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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 C28H32N2OS MW 444.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2OS/c1-20(2)32-27-29-25-23-14-8-7-13-22(23)19-28(16-9-4-10-17-28)24(25)26(31)30(27)18-15-21-11-5-3-6-12-21/h3,5-8,11-14,20H,4,9-10,15-19H2,1-2H3InChIKey
WSPFGJQGVIPFSL-UHFFFAOYSA-NSynonyms
2(isopropylthio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2phenylethyl)2(propan2ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(2phenylethyl)2propan2ylsulfanylspiro(6Hbenzo(h)quinazoline51cyclohexane)4one
3PHENETHYL2PROPAN2YLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC(C)SC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC28H32N2OSc120(2)322729252314871322(23)1928(1694101728)24(25)26(31)30(27)181521115361221h358111420H49101519H212H3
MFCD01807186
ZINC000001818655
ZINC01818655
ZINC1818655
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