Vitas-M small molecule compound
4-(2-methoxyphenyl)-1-(pentylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Catalog ID
STK526328
SMILES CCCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccccc1OC)CCCCC3
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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 C30H34N4O2S MW 514.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O2S/c1-3-4-12-19-37-29-32-31-28-33(23-15-8-9-16-24(23)36-2)27(35)25-26(34(28)29)22-14-7-6-13-21(22)20-30(25)17-10-5-11-18-30/h6-9,13-16H,3-5,10-12,17-20H2,1-2H3InChIKey
YJJZLJCWWNHUMJ-UHFFFAOYSA-NSynonyms
374549-60-7374549607
4(2methoxyphenyl)1(pentylsulfanyl)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
4(2methoxyphenyl)1(pentylthio)4Hspiro(benzo(h)(124)triazolo(43a)quinazoline61cyclohexan)5(7H)one
CCCCCSC1=NN=C2N1C3=C(C(=O)N2C4=CC=CC=C4OC)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC30H34N4O2Sc1341219372932312833(2315891624(23)362)27(35)2526(34(28)29)2214761321(22)2030(25)17105111830h691316H3510121720H212H3
MFCD01957250
ZINC000013775241
ZINC13775241
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