Vitas-M small molecule compound

methyl 4-(4-ethoxyphenyl)-2-oxo-6-[(4-phenyl-3,6-dihydropyridin-1(2H)-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027906
SMILES CCOc1ccc(cc1)C1NC(=O)NC(=C1C(=O)OC)CN1CCC(=CC1)c1ccccc1

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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-3-33-21-11-9-20(10-12-21)24-23(25(30)32-2)22(27-26(31)28-24)17-29-15-13-19(14-16-29)18-7-5-4-6-8-18/h4-13,24H,3,14-17H2,1-2H3,(H2,27,28,31)
InChIKey
PQIPTWRBXSSOBF-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCC(=CC3)C4=CC=CC=C4)C(=O)OC
InChI=1SC26H29N3O4c13332111920(101221)2423(25(30)322)22(2726(31)2824)1729151319(141629)187546818h41324H31417H212H3(H2272831)
methyl4(4ethoxyphenyl)2oxo6((4phenyl36dihydro2Hpyridin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
methyl4(4ethoxyphenyl)2oxo6((4phenyl36dihydropyridin1(2H)yl)methyl)1234tetrahydropyrimidine5carboxylate
MFCD18188497
ZINC000057415350
ZINC000057415352

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Available files

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