Vitas-M small molecule compound
ethyl 4-({2-[(4,6-diaminopyrimidin-2-yl)sulfanyl]butanoyl}amino)benzoate
Catalog ID
STK209072
SMILES CCC(C(=O)Nc1ccc(cc1)C(=O)OCC)Sc1nc(N)cc(n1)N
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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 C17H21N5O3S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O3S/c1-3-12(26-17-21-13(18)9-14(19)22-17)15(23)20-11-7-5-10(6-8-11)16(24)25-4-2/h5-9,12H,3-4H2,1-2H3,(H,20,23)(H4,18,19,21,22)InChIKey
FSAUGUSECFJABW-UHFFFAOYSA-NSynonyms
713080-74-1713080741
CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)SC2=NC(=CC(=N2)N)N
ETHYL4((2((46DIAMINOPYRIMIDIN2YL)SULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(2(46DIAMINOPYRIMIDIN2YL)SULFANYLBUTANOYLAMINO)BENZOATE
InChI=1SC17H21N5O3Sc1312(26172113(18)914(19)2217)15(23)20117510(6811)16(24)2542h5912H34H212H3(H2023)(H418192122)
MFCD05998070
ZINC000002866306
ZINC000002866307
ZINC02866306
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