Vitas-M small molecule compound
3-benzyl-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK805037
SMILES CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C27H30N2OS MW 430.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2OS/c1-19(2)31-26-28-24-22-14-8-7-13-21(22)17-27(15-9-4-10-16-27)23(24)25(30)29(26)18-20-11-5-3-6-12-20/h3,5-8,11-14,19H,4,9-10,15-18H2,1-2H3InChIKey
NTAKMMRFLWZEFU-UHFFFAOYSA-NSynonyms
332849-65-72(METHYLETHYLTHIO)3BENZYLSPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
332849657
3BENZYL2(ISOPROPYLSULFANYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
3benzyl2(isopropylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3benzyl2(propan2ylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2PROPAN2YLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC(C)SC1=NC2=C(C(=O)N1CC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC27H30N2OSc119(2)312628242214871321(22)1727(1594101627)23(24)25(30)29(26)1820115361220h358111419H49101518H212H3
MFCD01807166
ZINC000002183003
ZINC02183003
ZINC2183003
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