Vitas-M small molecule compound
(2E)-3-[2-(4-benzylpiperidin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK611419
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCC(CC1)Cc1ccccc1)/S(=O)(=O)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 C30H28N4O3S MW 524.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O3S/c1-22-9-8-16-34-28(22)32-29(33-17-14-24(15-18-33)19-23-10-4-2-5-11-23)27(30(34)35)20-26(21-31)38(36,37)25-12-6-3-7-13-25/h2-13,16,20,24H,14-15,17-19H2,1H3/b26-20+InChIKey
ACKWCDPDNQUJQR-LHLOQNFPSA-NSynonyms
799776-03-7(2E)3(2(4benzylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)prop2enenitrile
(E)2(BENZENESULFONYL)3(2(4BENZYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)3(2(4benzylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)acrylonitrile
799776037
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)N4CCC(CC4)CC5=CC=CC=C5
InChI=1SC30H28N4O3Sc12298163428(22)3229(33171424(151833)1923104251123)27(30(34)35)2026(2131)38(3637)25126371325h213162024H14151719H21H3b2620+
MFCD03672670
N#CC(=Cc1c(nc2n(c1=O)cccc2C)N1CCC(CC1)Cc1ccccc1)S(=O)(=O)c1ccccc1
ZINC000002207074
ZINC2207074
Check stock
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