Vitas-M small molecule compound
9-(3-ethoxy-4-hydroxyphenyl)-6-[4-(propan-2-yl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK217428
SMILES CCOc1cc(ccc1O)C1C2=C(CC(CC2=O)c2ccc(cc2)C(C)C)Nc2n1ncn2
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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 C26H28N4O3 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3/c1-4-33-23-13-18(9-10-21(23)31)25-24-20(29-26-27-14-28-30(25)26)11-19(12-22(24)32)17-7-5-16(6-8-17)15(2)3/h5-10,13-15,19,25,31H,4,11-12H2,1-3H3,(H,27,28,29)InChIKey
CYXWTFDFEVFQNW-UHFFFAOYSA-NSynonyms
727394-47-0727394470
9(3ethoxy4hydroxyphenyl)6(4(propan2yl)phenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3ethoxy4hydroxyphenyl)6(4isopropylphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(3ethoxy4hydroxyphenyl)6(4propan2ylphenyl)5679tetrahydro1H(124)triazolo(51b)quinazolin8one
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)C(C)C)N=C5N2NC=N5)O
InChI=1SC26H28N4O3c1433231318(91021(23)31)252420(292627142830(25)26)1119(1222(24)32)177516(6817)15(2)3h5101315192531H41112H213H3(H272829)
MFCD06192923
ZINC000006600464
ZINC000006600480
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