Vitas-M small molecule compound
methyl 4-(8-oxo-6-phenyl-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
Catalog ID
STL192143
SMILES COC(=O)c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccccc2)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 C23H20N4O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3/c1-30-22(29)16-9-7-15(8-10-16)21-20-18(26-23-24-13-25-27(21)23)11-17(12-19(20)28)14-5-3-2-4-6-14/h2-10,13,17,21H,11-12H2,1H3,(H,24,25,26)InChIKey
WTKVTUYNIDCHIC-UHFFFAOYSA-NSynonyms
900896-41-5900896415
COC(=O)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)N=C5N2NC=N5
InChI=1SC23H20N4O3c13022(29)169715(81016)212018(262324132527(21)23)1117(1219(20)28)145324614h210131721H1112H21H3(H242526)
methyl4(8oxo6phenyl456789hexahydro(124)triazolo(51b)quinazolin9yl)benzoate
methyl4(8oxo6phenyl5679tetrahydro1H(124)triazolo(51b)quinazolin9yl)benzoate
MFCD06778462
ZINC000005302210
ZINC000005302229
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