Vitas-M small molecule compound
3-benzyl-7-(4-chlorophenyl)-9-methylpyrimido[5',4':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Catalog ID
STK644974
SMILES Clc1ccc(cc1)c1nc(C)c2c(n1)sc1c2nnn(c1=O)Cc1ccccc1
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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 C21H14ClN5OS MW 419.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN5OS/c1-12-16-17-18(21(28)27(26-25-17)11-13-5-3-2-4-6-13)29-20(16)24-19(23-12)14-7-9-15(22)10-8-14/h2-10H,11H2,1H3InChIKey
LYJYZTLFMILBTF-UHFFFAOYSA-NSynonyms
951944-74-43benzyl7(4chlorophenyl)9methylpyrimido(12)thieno(34b)triazin4one
3benzyl7(4chlorophenyl)9methylpyrimido(5445)thieno(32d)(123)triazin4(3H)one
951944744
CC1=C2C3=C(C(=O)N(N=N3)CC4=CC=CC=C4)SC2=NC(=N1)C5=CC=C(C=C5)Cl
InChI=1SC21H14ClN5OSc112161718(21(28)27(262517)11135324613)2920(16)2419(2312)147915(22)10814h210H11H21H3
MFCD09854801
ZINC000013720195
ZINC13720195
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