Vitas-M small molecule compound
2-[(benzylsulfanyl)methyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK526172
SMILES O=c1[nH]c(CSCc2ccccc2)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 C25H26N2OS MW 402.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2OS/c28-24-22-23(26-21(27-24)17-29-16-18-9-3-1-4-10-18)20-12-6-5-11-19(20)15-25(22)13-7-2-8-14-25/h1,3-6,9-12H,2,7-8,13-17H2,(H,26,27,28)InChIKey
RPBHSHBPLYXRCF-UHFFFAOYSA-NSynonyms
350254-28-32((benzylsulfanyl)methyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((benzylthio)methyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((PHENYLMETHYLTHIO)METHYL)SPIRO(356TRIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
2(BENZYLSULFANYLMETHYL)SPIRO(16DIHYDROBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
350254283
C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N=C(N4)CSCC5=CC=CC=C5
InChI=1SC25H26N2OSc28242223(2621(2724)1729161893141018)2012651119(20)1525(22)137281425h136912H2781317H2(H262728)
MFCD00343399
O=c1(nH)c(CSCc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1
ZINC000017057712
ZINC17057712
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