Vitas-M small molecule compound

methyl 4-({2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate

Catalog ID
STK236225
SMILES COC(=O)c1ccc(cc1)NC(=O)C(Sc1nc(N)cc(=O)[nH]1)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 C15H16N4O4S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O4S/c1-8(24-15-18-11(16)7-12(20)19-15)13(21)17-10-5-3-9(4-6-10)14(22)23-2/h3-8H,1-2H3,(H,17,21)(H3,16,18,19,20)
InChIKey
UMQOUFCGOITHAJ-UHFFFAOYSA-N
Synonyms
878669-50-2
4(2(4AMINO6OXO16DIHYDROPYRIMIDIN2YLSULFANYL)PROPIONYLAMINO)BENZOIC
878669502
CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=NC(=O)C=C(N2)N
COC(=O)c1ccc(cc1)NC(=O)C(Sc1nc(N)cc(=O)(nH)1)C
InChI=1SC15H16N4O4Sc18(24151811(16)712(20)1915)13(21)1710539(4610)14(22)232h38H12H3(H1721)(H316181920)
METHYL4((2((4AMINO6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)PROPANOYL)AMINO)BENZOATE
METHYL4(2((6AMINO4OXO1HPYRIMIDIN2YL)SULFANYL)PROPANOYLAMINO)BENZOATE
MFCD07392277
ZINC000004905190
ZINC000004905202

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Available files

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