Vitas-M small molecule compound
(2E)-3-[9-methyl-4-oxo-2-(4-phenylpiperazin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK706785
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccccc1)/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 C28H25N5O3S MW 511.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O3S/c1-21-9-8-14-33-26(21)30-27(32-17-15-31(16-18-32)22-10-4-2-5-11-22)25(28(33)34)19-24(20-29)37(35,36)23-12-6-3-7-13-23/h2-14,19H,15-18H2,1H3/b24-19+InChIKey
SRTPFMMBGSEJBS-LYBHJNIJSA-NSynonyms
799771-02-1(2E)3(9methyl4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)prop2enenitrile
(E)2(BENZENESULFONYL)3(9METHYL4OXO2(4PHENYLPIPERAZIN1YL)PYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)3(9methyl4oxo2(4phenylpiperazin1yl)4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)acrylonitrile
799771021
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5
InChI=1SC28H25N5O3Sc12198143326(21)3027(32171531(161832)22104251122)25(28(33)34)1924(2029)37(3536)23126371323h21419H1518H21H3b2419+
MFCD03671711
N#CC(=Cc1c(nc2n(c1=O)cccc2C)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1ccccc1
ZINC000002204421
ZINC2204421
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