Vitas-M small molecule compound
2-[(3-methylbenzyl)sulfanyl]-3-propyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK551683
SMILES CCCn1c(SCc2cccc(c2)C)nc2c(c1=O)C1(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 C28H32N2OS MW 444.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2OS/c1-3-16-30-26(31)24-25(29-27(30)32-19-21-11-9-10-20(2)17-21)23-13-6-5-12-22(23)18-28(24)14-7-4-8-15-28/h5-6,9-13,17H,3-4,7-8,14-16,18-19H2,1-2H3InChIKey
NIXVHVIQMRCUGI-UHFFFAOYSA-NSynonyms
799828-55-02((3methylbenzyl)sulfanyl)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((3methylbenzyl)thio)3propyl3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((3METHYLPHENYL)METHYLSULFANYL)3PROPYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799828550
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=CC(=C5)C
InChI=1SC28H32N2OSc13163026(31)2425(2927(30)3219211191020(2)1721)2313651222(23)1828(24)147481528h5691317H347814161819H212H3
MFCD03683726
ZINC000002240619
ZINC02240619
ZINC2240619
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