Vitas-M small molecule compound
6-{[4,6-bis(propan-2-ylamino)-1,3,5-triazin-2-yl]oxy}pyridazin-3-yl 4-methylbenzenesulfonate
Catalog ID
STL334025
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(nn1)Oc1nc(NC(C)C)nc(n1)NC(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 C20H25N7O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N7O4S/c1-12(2)21-18-23-19(22-13(3)4)25-20(24-18)30-16-10-11-17(27-26-16)31-32(28,29)15-8-6-14(5)7-9-15/h6-13H,1-5H3,(H2,21,22,23,24,25)InChIKey
NHXONJRESQJRNC-UHFFFAOYSA-NSynonyms
488745-10-4(6((46BIS(PROPAN2YLAMINO)135TRIAZIN2YL)OXY)PYRIDAZIN3YL)4METHYLBENZENESULFONATE
488745104
6((46bis(isopropylamino)135triazin2yl)oxy)pyridazin3yl4methylbenzenesulfonate
6((46bis(propan2ylamino)135triazin2yl)oxy)pyridazin3yl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=NN=C(C=C2)OC3=NC(=NC(=N3)NC(C)C)NC(C)C
InChI=1SC20H25N7O4Sc112(2)21182319(2213(3)4)2520(2418)3016101117(272616)3132(2829)158614(5)7915h613H15H3(H22122232425)
MFCD02855691
ZINC000001813455
ZINC01813455
ZINC1813455
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