Vitas-M small molecule compound
ethyl 4-({2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]butanoyl}amino)benzoate
Catalog ID
STK209078
SMILES CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc1nc(N)cc(=O)[nH]1
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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 C17H20N4O4S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O4S/c1-3-12(26-17-20-13(18)9-14(22)21-17)15(23)19-11-7-5-10(6-8-11)16(24)25-4-2/h5-9,12H,3-4H2,1-2H3,(H,19,23)(H3,18,20,21,22)InChIKey
NVMRDVUPUDPLAP-UHFFFAOYSA-NSynonyms
713080-78-5713080785
CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)SC2=NC(=O)C=C(N2)N
CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc1nc(N)cc(=O)(nH)1
ETHYL4((2((4AMINO6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(2((6AMINO4OXO1HPYRIMIDIN2YL)SULFANYL)BUTANOYLAMINO)BENZOATE
InChI=1SC17H20N4O4Sc1312(26172013(18)914(22)2117)15(23)19117510(6811)16(24)2542h5912H34H212H3(H1923)(H318202122)
MFCD05998072
ZINC000011535505
ZINC000018211907
ZINC02866308
ZINC02866309
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