Vitas-M small molecule compound
3-butyl-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK547266
SMILES CCCCn1c(SCCCCC)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 C26H36N2OS MW 424.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N2OS/c1-3-5-12-18-30-25-27-23-21-14-9-8-13-20(21)19-26(15-10-7-11-16-26)22(23)24(29)28(25)17-6-4-2/h8-9,13-14H,3-7,10-12,15-19H2,1-2H3InChIKey
GPKXOVUKJVLEII-UHFFFAOYSA-NSynonyms
488093-86-33butyl2(pentylsulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3butyl2(pentylthio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3BUTYL2PENTYLSULFANYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
488093863
CCCCCSC1=NC2=C(C(=O)N1CCCC)C3(CCCCC3)CC4=CC=CC=C42
InChI=1SC26H36N2OSc1351218302527232114981320(21)1926(15107111626)22(23)24(29)28(25)17642h891314H3710121519H212H3
MFCD03288096
ZINC000002326017
ZINC02326017
ZINC2326017
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