Vitas-M small molecule compound
2-[(2-methylbenzyl)sulfanyl]-3-(2-phenylethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK553347
SMILES Cc1ccccc1CSc1nc2c3ccccc3CC3(c2c(=O)n1CCc1ccccc1)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 C33H34N2OS MW 506.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34N2OS/c1-24-12-6-7-16-27(24)23-37-32-34-30-28-17-9-8-15-26(28)22-33(19-10-3-11-20-33)29(30)31(36)35(32)21-18-25-13-4-2-5-14-25/h2,4-9,12-17H,3,10-11,18-23H2,1H3InChIKey
KKLFGCKNRHMIKC-UHFFFAOYSA-NSynonyms
799824-00-32((2methylbenzyl)sulfanyl)3(2phenylethyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2methylbenzyl)thio)3phenethyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2methylphenyl)methylsulfanyl)3(2phenylethyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)4one
2((2METHYLPHENYL)METHYLSULFANYL)3PHENETHYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799824003
CC1=CC=CC=C1CSC2=NC3=C(C(=O)N2CCC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC33H34N2OSc12412671627(24)23373234302817981526(28)2233(19103112033)29(30)31(36)35(32)211825134251425h2491217H310111823H21H3
MFCD03682558
ZINC000002236904
ZINC02236904
ZINC2236904
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