Vitas-M small molecule compound

(2E)-3-[2-(4-benzylpiperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide

Catalog ID
STK903899
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCN(CC1)Cc1ccccc1)/C(=O)NC1CCCCC1

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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 C29H32N6O2 MW 496.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O2/c30-20-23(28(36)31-24-11-5-2-6-12-24)19-25-27(32-26-13-7-8-14-35(26)29(25)37)34-17-15-33(16-18-34)21-22-9-3-1-4-10-22/h1,3-4,7-10,13-14,19,24H,2,5-6,11-12,15-18,21H2,(H,31,36)/b23-19+
InChIKey
NRUYWZSWQBWVSY-FCDQGJHFSA-N
Synonyms
797800-04-5
(2E)3(2(4benzylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylprop2enamide
(E)3(2(4benzylpiperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylacrylamide
(E)3(2(4BENZYLPIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANONCYCLOHEXYLPROP2ENAMIDE
797800045
C1CCC(CC1)NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)CC5=CC=CC=C5)C#N
InChI=1SC29H32N6O2c302023(28(36)3124115261224)192527(322613781435(26)29(25)37)34171533(161834)212293141022h13471013141924H2561112151821H2(H3136)b2319+
MFCD03668817
N#CC(=Cc1c(nc2n(c1=O)cccc2)N1CCN(CC1)Cc1ccccc1)C(=O)NC1CCCCC1
ZINC000013647975
ZINC13647975

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Available files

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