Vitas-M small molecule compound
1-{3-[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxamide
Catalog ID
STK904641
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCC(CC1)C(=O)N)/C(=O)NCc1ccccc1
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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 C25H24N6O3 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6O3/c26-15-19(24(33)28-16-17-6-2-1-3-7-17)14-20-23(30-12-9-18(10-13-30)22(27)32)29-21-8-4-5-11-31(21)25(20)34/h1-8,11,14,18H,9-10,12-13,16H2,(H2,27,32)(H,28,33)/b19-14+InChIKey
SLWJPCYTFZQTFW-XMHGGMMESA-NSynonyms
799771-06-5(E)1(3(3(benzylamino)2cyano3oxoprop1en1yl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((1E)3(benzylamino)2cyano3oxoprop1en1yl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((E)3(BENZYLAMINO)2CYANO3OXOPROP1ENYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
799771065
C1CN(CCC1C(=O)N)C2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NCC4=CC=CC=C4
InChI=1SC25H24N6O3c261519(24(33)2816176213717)142023(3012918(101330)22(27)32)29218451131(21)25(20)34h18111418H910121316H2(H22732)(H2833)b1914+
MFCD03671722
N#CC(=Cc1c(nc2n(c1=O)cccc2)N1CCC(CC1)C(=O)N)C(=O)NCc1ccccc1
ZINC000002204438
ZINC2204438
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.