Vitas-M small molecule compound

methyl 6-({4-[(tert-butoxycarbonyl)amino]piperidin-1-yl}methyl)-4-(2-chlorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027807
SMILES COC(=O)C1=C(CN2CCC(CC2)NC(=O)OC(C)(C)C)NC(=O)NC1c1ccccc1Cl

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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 C23H31ClN4O5 MW 478.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31ClN4O5/c1-23(2,3)33-22(31)25-14-9-11-28(12-10-14)13-17-18(20(29)32-4)19(27-21(30)26-17)15-7-5-6-8-16(15)24/h5-8,14,19H,9-13H2,1-4H3,(H,25,31)(H2,26,27,30)
InChIKey
BAUJNGHCDKXJBL-UHFFFAOYSA-N
Synonyms

CC(C)(C)OC(=O)NC1CCN(CC1)CC2=C(C(NC(=O)N2)C3=CC=CC=C3Cl)C(=O)OC
InChI=1SC23H31ClN4O5c123(23)3322(31)251491128(121014)131718(20(29)324)19(2721(30)2617)15756816(15)24h581419H913H214H3(H2531)(H2262730)
methyl4(2chlorophenyl)6((4((2methylpropan2yl)oxycarbonylamino)piperidin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
methyl6((4((tertbutoxycarbonyl)amino)piperidin1yl)methyl)4(2chlorophenyl)2oxo1234tetrahydropyrimidine5carboxylate
MFCD18188400
ZINC000057414927
ZINC000057414930

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Available files

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