Vitas-M small molecule compound
2-(hexylsulfanyl)-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698959
SMILES CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)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 C29H34N2OS MW 458.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2OS/c1-2-3-4-13-20-33-28-30-26-24-17-10-9-14-22(24)21-29(18-11-6-12-19-29)25(26)27(32)31(28)23-15-7-5-8-16-23/h5,7-10,14-17H,2-4,6,11-13,18-21H2,1H3InChIKey
AHBCFUSKJFUVQV-UHFFFAOYSA-NSynonyms
371936-40-22(hexylsulfanyl)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(hexylthio)3phenyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2HEXYLSULFANYL3PHENYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
371936402
CCCCCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H34N2OSc123413203328302624171091422(24)2129(18116121929)25(26)27(32)31(28)23157581623h57101417H24611131821H21H3
MFCD01807160
ZINC000002268210
ZINC02268210
ZINC2268210
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