Vitas-M small molecule compound
ethyl 1-{3-[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxylate
Catalog ID
STK906229
SMILES CCOC(=O)C1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C(/C(=O)NCc1ccccc1)\C#N
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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 C28H29N5O4 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O4/c1-3-37-28(36)21-11-14-32(15-12-21)25-23(27(35)33-13-7-8-19(2)24(33)31-25)16-22(17-29)26(34)30-18-20-9-5-4-6-10-20/h4-10,13,16,21H,3,11-12,14-15,18H2,1-2H3,(H,30,34)/b22-16+InChIKey
RJAABCXWSHYDRB-CJLVFECKSA-NSynonyms
877778-42-2(E)ethyl1(3(3(benzylamino)2cyano3oxoprop1en1yl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
877778422
CCOC(=O)C1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C(C(=O)NCc1ccccc1)C#N
CCOC(=O)C1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)NCC4=CC=CC=C4
ethyl1(3((1E)3(benzylamino)2cyano3oxoprop1en1yl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
ETHYL1(3((E)3(BENZYLAMINO)2CYANO3OXOPROP1ENYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
InChI=1SC28H29N5O4c133728(36)21111432(151221)2523(27(35)33137819(2)24(33)3125)1622(1729)26(34)30182095461020h410131621H31112141518H212H3(H3034)b2216+
MFCD03672851
ZINC000013811101
ZINC13811101
Check stock
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