Vitas-M small molecule compound
methyl 4-(4-ethylphenyl)-2-oxo-6-(thiomorpholin-4-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL027874
SMILES COC(=O)C1=C(CN2CCSCC2)NC(=O)NC1c1ccc(cc1)CC
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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 C19H25N3O3S MW 375.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O3S/c1-3-13-4-6-14(7-5-13)17-16(18(23)25-2)15(20-19(24)21-17)12-22-8-10-26-11-9-22/h4-7,17H,3,8-12H2,1-2H3,(H2,20,21,24)InChIKey
PNBOLHDALQFDDS-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCSCC3)C(=O)OC
InChI=1SC19H25N3O3Sc13134614(7513)1716(18(23)252)15(2019(24)2117)12228102611922h4717H3812H212H3(H2202124)
methyl4(4ethylphenyl)2oxo6(thiomorpholin4ylmethyl)1234tetrahydropyrimidine5carboxylate
methyl4(4ethylphenyl)2oxo6(thiomorpholin4ylmethyl)34dihydro1Hpyrimidine5carboxylate
MFCD18188465
ZINC000057415192
ZINC000057415195
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