Vitas-M small molecule compound

methyl 6-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-4-(4-ethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027889
SMILES COC(=O)C1=C(CN2CCN(CC2)c2cc(Cl)ccc2C)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 C26H31ClN4O3 MW 483.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClN4O3/c1-4-18-6-8-19(9-7-18)24-23(25(32)34-3)21(28-26(33)29-24)16-30-11-13-31(14-12-30)22-15-20(27)10-5-17(22)2/h5-10,15,24H,4,11-14,16H2,1-3H3,(H2,28,29,33)
InChIKey
YDSDKCUHUJBPBV-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C(=O)OC
InChI=1SC26H31ClN4O3c14186819(9718)2423(25(32)343)21(2826(33)2924)1630111331(141230)221520(27)10517(22)2h5101524H4111416H213H3(H2282933)
methyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD18188480
ZINC000067689660
ZINC000067689661

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Available files

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