Vitas-M small molecule compound
2-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)-4,5-diethoxybenzonitrile
Catalog ID
STK773646
SMILES CCOc1cc(c(cc1OCC)C#N)n1nnc2c(c1=O)sc1c2c(C)cc(n1)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 C21H19N5O3S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5O3S/c1-5-28-15-8-13(10-22)14(9-16(15)29-6-2)26-21(27)19-18(24-25-26)17-11(3)7-12(4)23-20(17)30-19/h7-9H,5-6H2,1-4H3InChIKey
HNDHTUGWEZAZMR-UHFFFAOYSA-NSynonyms
2(79dimethyl4oxopyrido(23)thieno(24b)triazin3yl)45diethoxybenzonitrile
2(79dimethyl4oxopyrido(3245)thieno(32d)(123)triazin3(4H)yl)45diethoxybenzonitrile
CCOC1=C(C=C(C(=C1)C#N)N2C(=O)C3=C(C4=C(S3)N=C(C=C4C)C)N=N2)OCC
InChI=1SC21H19N5O3Sc152815813(1022)14(916(15)2962)2621(27)1918(242526)1711(3)712(4)2320(17)3019h79H56H214H3
MFCD03855220
ZINC000001080617
ZINC01080617
ZINC1080617
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