Vitas-M small molecule compound
9-[4-(dimethylamino)phenyl]-6,6-dimethyl-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Catalog ID
STK768168
SMILES CSc1nc2n(n1)C(c1ccc(cc1)N(C)C)C1=C(N2)CC(CC1=O)(C)C
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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 C20H25N5OS MW 383.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5OS/c1-20(2)10-14-16(15(26)11-20)17(12-6-8-13(9-7-12)24(3)4)25-18(21-14)22-19(23-25)27-5/h6-9,17H,10-11H2,1-5H3,(H,21,22,23)InChIKey
VPEGXXRVCZUOFG-UHFFFAOYSA-NSynonyms
9(4(dimethylamino)phenyl)66dimethyl2(methylsulfanyl)5679tetrahydro(124)triazolo(51b)quinazolin8(4H)one
9(4(dimethylamino)phenyl)66dimethyl2methylsulfanyl1579tetrahydro(124)triazolo(51b)quinazolin8one
CC1(CC2=C(C(N3C(=N2)N=C(N3)SC)C4=CC=C(C=C4)N(C)C)C(=O)C1)C
InChI=1SC20H25N5OSc120(2)101416(15(26)1120)17(126813(9712)24(3)4)2518(2114)2219(2325)275h6917H1011H215H3(H212223)
MFCD03133535
ZINC000001087982
ZINC000001087983
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