Vitas-M small molecule compound
2-(benzylsulfanyl)-3-(cyclopentylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK805805
SMILES O=c1n(CC2CCCC2)c(SCc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1
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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 C30H34N2OS MW 470.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2OS/c33-28-26-27(25-16-8-7-15-24(25)19-30(26)17-9-2-10-18-30)31-29(32(28)20-22-11-5-6-12-22)34-21-23-13-3-1-4-14-23/h1,3-4,7-8,13-16,22H,2,5-6,9-12,17-21H2InChIKey
PNFHTCGXMOXRMI-UHFFFAOYSA-NSynonyms
312626-12-32(benzylsulfanyl)3(cyclopentylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(BENZYLSULFANYL)3(CYCLOPENTYLMETHYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
2(benzylthio)3(cyclopentylmethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BENZYLSULFANYL3(CYCLOPENTYLMETHYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
312626123
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC5=CC=CC=C5)CC6CCCC6
InChI=1SC30H34N2OSc33282627(2516871524(25)1930(26)1792101830)3129(32(28)202211561222)342123133141423h13478131622H2569121721H2
MFCD00688852
ZINC000002069126
ZINC02069126
ZINC2069126
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