Vitas-M small molecule compound
2-(benzylsulfanyl)-3-(2-methylprop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK805786
SMILES CC(=C)Cn1c(SCc2ccccc2)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 C28H30N2OS MW 442.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2OS/c1-20(2)18-30-26(31)24-25(29-27(30)32-19-21-11-5-3-6-12-21)23-14-8-7-13-22(23)17-28(24)15-9-4-10-16-28/h3,5-8,11-14H,1,4,9-10,15-19H2,2H3InChIKey
BDOFOSZSFUNVLS-UHFFFAOYSA-NSynonyms
352701-65-62(BENZYLSULFANYL)3(2METHYL2PROPENYL)56DIHYDROSPIRO(BENZO(H)QUINAZOLINE51CYCLOHEXANE)4(3H)ONE
2(benzylsulfanyl)3(2methylprop2en1yl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2(benzylthio)3(2methylallyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2BENZYLSULFANYL3(2METHYLPROP2ENYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
352701656
CC(=C)CN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC5=CC=CC=C5
InChI=1SC28H30N2OSc120(2)183026(31)2425(2927(30)321921115361221)2314871322(23)1728(24)1594101628h3581114H149101519H22H3
MFCD01556990
ZINC000001826472
ZINC01826472
ZINC1826472
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