Vitas-M small molecule compound
(2E)-3-[2-(4-ethylpiperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK881719
SMILES CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C(/S(=O)(=O)c1ccccc1)\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 C24H25N5O3S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O3S/c1-3-27-12-14-28(15-13-27)23-21(24(30)29-11-7-8-18(2)22(29)26-23)16-20(17-25)33(31,32)19-9-5-4-6-10-19/h4-11,16H,3,12-15H2,1-2H3/b20-16+InChIKey
PYNRIOOMHAZTGE-CAPFRKAQSA-NSynonyms
1164466-32-3(2E)3(2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)prop2enenitrile
(E)2(BENZENESULFONYL)3(2(4ETHYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)3(2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)acrylonitrile
1164466323
CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C(S(=O)(=O)c1ccccc1)C#N
CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)S(=O)(=O)C4=CC=CC=C4
InChI=1SC24H25N5O3Sc1327121428(151327)2321(24(30)29117818(2)22(29)2623)1620(1725)33(3132)1995461019h41116H31215H212H3b2016+
MFCD03668875
ZINC000004326892
ZINC4326892
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