Vitas-M small molecule compound
2-(methylsulfanyl)ethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK012522
SMILES CSCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)[N+](=O)[O-]
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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 C15H17N3O5S MW 351.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O5S/c1-9-12(14(19)23-6-7-24-2)13(17-15(20)16-9)10-4-3-5-11(8-10)18(21)22/h3-5,8,13H,6-7H2,1-2H3,(H2,16,17,20)InChIKey
BQZKWQTYBUIYCJ-UHFFFAOYSA-NSynonyms
2(methylsulfanyl)ethyl6methyl4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
2METHYLSULFANYLETHYL6METHYL4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2METHYLTHIOETHYL4METHYL6(3NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCCSC
CSCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)(N+)(=O)(O)
InChI=1SC15H17N3O5Sc1912(14(19)2367242)13(1715(20)169)1043511(810)18(21)22h35813H67H212H3(H2161720)
MFCD01193037
STK012522
ZINC000003900947
ZINC000003900948
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