Vitas-M small molecule compound
3-benzyl-2-[(2,4-dichlorobenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK541140
SMILES Clc1ccc(c(c1)Cl)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C31H28Cl2N2OS MW 547.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28Cl2N2OS/c32-24-14-13-23(26(33)17-24)20-37-30-34-28-25-12-6-5-11-22(25)18-31(15-7-2-8-16-31)27(28)29(36)35(30)19-21-9-3-1-4-10-21/h1,3-6,9-14,17H,2,7-8,15-16,18-20H2InChIKey
WMWAGJWMXBNNKI-UHFFFAOYSA-NSynonyms
371130-67-5371130675
3benzyl2((24dichlorobenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3benzyl2((24dichlorobenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BENZYL2((24DICHLOROPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC5=C(C=C(C=C5)Cl)Cl)CC6=CC=CC=C6
InChI=1SC31H28Cl2N2OSc3224141323(26(33)1724)20373034282512651122(25)1831(157281631)27(28)29(36)35(30)192193141021h13691417H27815161820H2
MFCD03008355
ZINC000001814637
ZINC01814637
ZINC1814637
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