Vitas-M small molecule compound
2-[(4-bromobenzyl)sulfanyl]-3-(2-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK530740
SMILES Brc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)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 C31H29BrN2OS MW 557.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrN2OS/c1-21-9-3-6-12-26(21)34-29(35)27-28(33-30(34)36-20-22-13-15-24(32)16-14-22)25-11-5-4-10-23(25)19-31(27)17-7-2-8-18-31/h3-6,9-16H,2,7-8,17-20H2,1H3InChIKey
XAKLPBVYEBSLME-UHFFFAOYSA-NSynonyms
2((4bromobenzyl)sulfanyl)3(2methylphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4bromobenzyl)thio)3(otolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((4BROMOPHENYL)METHYLSULFANYL)3(2METHYLPHENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC6=CC=C(C=C6)Br
InChI=1SC31H29BrN2OSc1219361226(21)3429(35)2728(3330(34)362022131524(32)161422)2511541023(25)1931(27)177281831h36916H2781720H21H3
MFCD01993052
ZINC000001873654
ZINC01873654
ZINC1873654
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