Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-3-(2-methylpropyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK557090
SMILES CC(Cn1c(SCc2ccccc2Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1)C
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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 C28H31ClN2OS MW 479.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN2OS/c1-19(2)17-31-26(32)24-25(30-27(31)33-18-21-11-5-7-13-23(21)29)22-12-6-4-10-20(22)16-28(24)14-8-3-9-15-28/h4-7,10-13,19H,3,8-9,14-18H2,1-2H3InChIKey
FYWVZQHRZDIDJL-UHFFFAOYSA-NSynonyms
577997-27-42((2chlorobenzyl)sulfanyl)3(2methylpropyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2chlorobenzyl)thio)3isobutyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2CHLOROPHENYL)METHYLSULFANYL)3(2METHYLPROPYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
577997274
CC(C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=CC=C5Cl
InChI=1SC28H31ClN2OSc119(2)173126(32)2425(3027(31)33182111571323(21)29)2212641020(22)1628(24)148391528h47101319H3891418H212H3
MFCD04022595
ZINC000002361399
ZINC02361399
ZINC2361399
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