Vitas-M small molecule compound
(2E)-2-[(4-chlorophenyl)sulfonyl]-3-[2-(2,4-dichlorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Catalog ID
STK801167
SMILES N#C/C(=C\c1c(Oc2ccc(cc2Cl)Cl)nc2n(c1=O)cccc2)/S(=O)(=O)c1ccc(cc1)Cl
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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 C23H12Cl3N3O4S MW 532.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H12Cl3N3O4S/c24-14-4-7-16(8-5-14)34(31,32)17(13-27)12-18-22(33-20-9-6-15(25)11-19(20)26)28-21-3-1-2-10-29(21)23(18)30/h1-12H/b17-12+InChIKey
YCSADTQVYXATCG-SFQUDFHCSA-NSynonyms
620110-02-3(2E)2((4chlorophenyl)sulfonyl)3(2(24dichlorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enenitrile
(E)2((4chlorophenyl)sulfonyl)3(2(24dichlorophenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)acrylonitrile
(E)2(4CHLOROPHENYL)SULFONYL3(2(24DICHLOROPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
620110023
C1=CC2=NC(=C(C(=O)N2C=C1)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)OC4=C(C=C(C=C4)Cl)Cl
InChI=1SC23H12Cl3N3O4Sc24144716(8514)34(3132)17(1327)121822(33209615(25)1119(20)26)28213121029(21)23(18)30h112Hb1712+
MFCD04447315
N#CC(=Cc1c(Oc2ccc(cc2Cl)Cl)nc2n(c1=O)cccc2)S(=O)(=O)c1ccc(cc1)Cl
ZINC000002408714
ZINC2408714
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