Vitas-M small molecule compound
ethyl 4-amino-2-[({4-amino-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl}methyl)sulfanyl]pyrimidine-5-carboxylate
Catalog ID
STK137097
SMILES CCOC(=O)c1cnc(nc1N)SCc1nc(N)nc(n1)Nc1ccc(cc1)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 C18H20N8O2S MW 412.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N8O2S/c1-3-28-15(27)12-8-21-18(25-14(12)19)29-9-13-23-16(20)26-17(24-13)22-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H2,19,21,25)(H3,20,22,23,24,26)InChIKey
CESOFQSQWIOBJN-UHFFFAOYSA-NSynonyms
578005-90-0CCOC(=O)C1=CN=C(N=C1N)SCC2=NC(=NC(=N2)NC3=CC=C(C=C3)C)N
ETHYL4AMINO2((((4E)6AMINO4((4METHYLPHENYL)IMINO)45DIHYDRO135TRIAZIN2YL)METHYL)SULFANYL)PYRIMIDINE5CARBOXYLATE
ETHYL4AMINO2(((4AMINO6((4METHYLPHENYL)AMINO)135TRIAZIN2YL)METHYL)SULFANYL)PYRIMIDINE5CARBOXYLATE
ETHYL4AMINO2(((4AMINO6((4METHYLPHENYL)AMINO)135TRIAZIN2YL)METHYL)THIO)5PYRIMIDINECARBOXYLATE
ethyl4amino2(((4amino6(ptolylamino)135triazin2yl)methyl)thio)pyrimidine5carboxylate
ETHYL4AMINO2((4AMINO6(4METHYLANILINO)135TRIAZIN2YL)METHYLSULFANYL)PYRIMIDINE5CARBOXYLATE
InChI=1SC18H20N8O2Sc132815(27)1282118(2514(12)19)299132316(20)2617(2413)22116410(2)5711h48H39H212H3(H2192125)(H32022232426)
MFCD03871860
ZINC02204048
ZINC17249858
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