Vitas-M small molecule compound
3-(3-bromophenyl)-2-(hexylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK532408
SMILES CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)Br)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 C29H33BrN2OS MW 537.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33BrN2OS/c1-2-3-4-10-18-34-28-31-26-24-15-7-6-12-21(24)20-29(16-8-5-9-17-29)25(26)27(33)32(28)23-14-11-13-22(30)19-23/h6-7,11-15,19H,2-5,8-10,16-18,20H2,1H3InChIKey
ZLMTXSZXPRDKKZ-UHFFFAOYSA-NSynonyms
3(3bromophenyl)2(hexylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3bromophenyl)2(hexylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3BROMOPHENYL)2HEXYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CCCCCCSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)Br)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC29H33BrN2OSc12341018342831262415761221(24)2029(168591729)25(26)27(33)32(28)2314111322(30)1923h67111519H25810161820H21H3
MFCD02763770
ZINC000001829272
ZINC01829272
ZINC1829272
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