Vitas-M small molecule compound
2-(hexylsulfanyl)-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK698949
SMILES CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C31H38N2OS MW 486.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N2OS/c1-2-3-4-13-22-35-30-32-28-26-17-10-9-16-25(26)23-31(19-11-6-12-20-31)27(28)29(34)33(30)21-18-24-14-7-5-8-15-24/h5,7-10,14-17H,2-4,6,11-13,18-23H2,1H3InChIKey
YWZKLUNXGCTYTL-UHFFFAOYSA-NSynonyms
2(hexylsulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(hexylthio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2hexylsulfanyl3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)4one
2HEXYLSULFANYL3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCCSC1=NC2=C(C(=O)N1CCC3=CC=CC=C3)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC31H38N2OSc123413223530322826171091625(26)2331(19116122031)27(28)29(34)33(30)211824147581524h57101417H24611131823H21H3
MFCD01807190
ZINC000001761869
ZINC01761869
ZINC1761869
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