Vitas-M small molecule compound

ethyl 6-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(3-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL435741
SMILES CCOC(=O)C1=C(CSc2nnc(s2)N)NC(=O)NC1c1cccc(c1)OC

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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 C17H19N5O4S2 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O4S2/c1-3-26-14(23)12-11(8-27-17-22-21-15(18)28-17)19-16(24)20-13(12)9-5-4-6-10(7-9)25-2/h4-7,13H,3,8H2,1-2H3,(H2,18,21)(H2,19,20,24)
InChIKey
ARNVFMBQJXDDBU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)OC)CSC3=NN=C(S3)N
ethyl6(((5amino134thiadiazol2yl)sulfanyl)methyl)4(3methoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6((5AMINO134THIADIAZOL2YL)SULFANYLMETHYL)4(3METHOXYPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC17H19N5O4S2c132614(23)1211(82717222115(18)2817)1916(24)2013(12)954610(79)252h4713H38H212H3(H21821)(H2192024)
MFCD07155652
ZINC000013566264
ZINC000013566265

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.