Vitas-M small molecule compound
methyl 6-{[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL028052
SMILES COC(=O)C1=C(CN2CCN(CC2)c2cc(C)ccc2C)NC(=O)NC1c1cccs1
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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 C23H28N4O3S MW 440.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3S/c1-15-6-7-16(2)18(13-15)27-10-8-26(9-11-27)14-17-20(22(28)30-3)21(25-23(29)24-17)19-5-4-12-31-19/h4-7,12-13,21H,8-11,14H2,1-3H3,(H2,24,25,29)InChIKey
AHDYVZLAXNFDGH-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=C(C(NC(=O)N3)C4=CC=CS4)C(=O)OC
InChI=1SC23H28N4O3Sc1156716(2)18(1315)2710826(91127)141720(22(28)303)21(2523(29)2417)1954123119h47121321H81114H213H3(H2242529)
methyl6((4(25dimethylphenyl)piperazin1yl)methyl)2oxo4(thiophen2yl)1234tetrahydropyrimidine5carboxylate
methyl6((4(25dimethylphenyl)piperazin1yl)methyl)2oxo4thiophen2yl34dihydro1Hpyrimidine5carboxylate
MFCD18188643
ZINC000057415944
ZINC000057415947
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