Vitas-M small molecule compound
3-(3-bromophenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK836024
SMILES CC(=C)CSc1nc2c3ccccc3CC3(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 C27H27BrN2OS MW 507.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN2OS/c1-18(2)17-32-26-29-24-22-12-5-4-9-19(22)16-27(13-6-3-7-14-27)23(24)25(31)30(26)21-11-8-10-20(28)15-21/h4-5,8-12,15H,1,3,6-7,13-14,16-17H2,2H3InChIKey
BIYMGAGDUXHAOM-UHFFFAOYSA-NSynonyms
3(3bromophenyl)2((2methylallyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3bromophenyl)2((2methylprop2en1yl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(3BROMOPHENYL)2(2METHYLPROP2ENYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC(=C)CSC1=NC2=C(C(=O)N1C3=CC(=CC=C3)Br)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC27H27BrN2OSc118(2)1732262924221254919(22)1627(136371427)23(24)25(31)30(26)211181020(28)1521h4581215H136713141617H22H3
MFCD02642366
ZINC000001797697
ZINC01797697
ZINC1797697
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