Vitas-M small molecule compound
(2E)-3-[2-(4-benzylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
Catalog ID
STK903681
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCC(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 C30H33N5O2 MW 495.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N5O2/c31-21-24(29(36)32-25-11-5-2-6-12-25)20-26-28(33-27-13-7-8-16-35(27)30(26)37)34-17-14-23(15-18-34)19-22-9-3-1-4-10-22/h1,3-4,7-10,13,16,20,23,25H,2,5-6,11-12,14-15,17-19H2,(H,32,36)/b24-20+InChIKey
PUAPUMPASCOCJD-HIXSDJFHSA-NSynonyms
799768-86-8(2E)3(2(4benzylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylprop2enamide
(E)3(2(4benzylpiperidin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylacrylamide
(E)3(2(4BENZYLPIPERIDIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANONCYCLOHEXYLPROP2ENAMIDE
799768868
C1CCC(CC1)NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCC(CC4)CC5=CC=CC=C5)C#N
InChI=1SC30H33N5O2c312124(29(36)3225115261225)202628(332713781635(27)30(26)37)34171423(151834)192293141022h1347101316202325H256111214151719H2(H3236)b2420+
MFCD03670915
N#CC(=Cc1c(nc2n(c1=O)cccc2)N1CCC(CC1)Cc1ccccc1)C(=O)NC1CCCCC1
ZINC000009075450
ZINC9075450
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