Vitas-M small molecule compound
2-(benzylsulfanyl)-4-(piperidin-1-yl)-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexane]
Catalog ID
STK938567
SMILES C1CCN(CC1)c1nc(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 C29H33N3S MW 455.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N3S/c1-4-12-22(13-5-1)21-33-28-30-26-24-15-7-6-14-23(24)20-29(16-8-2-9-17-29)25(26)27(31-28)32-18-10-3-11-19-32/h1,4-7,12-15H,2-3,8-11,16-21H2InChIKey
JCIMPSLFZBFIAN-UHFFFAOYSA-NSynonyms
844833-41-62(benzylsulfanyl)4(piperidin1yl)6Hspiro(benzo(h)quinazoline51cyclohexane)
2(benzylthio)4(piperidin1yl)6Hspiro(benzo(h)quinazoline51cyclohexane)
2BENZYLSULFANYL4PIPERIDIN1YLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)
844833416
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=NC(=N4)SCC5=CC=CC=C5)N6CCCCC6
InChI=1SC29H33N3Sc141222(1351)21332830262415761423(24)2029(168291729)25(26)27(3128)3218103111932h1471215H238111621H2
MFCD04163634
ZINC000002410236
ZINC02410236
ZINC2410236
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