Vitas-M small molecule compound
(2E)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-[(2-oxo-2H-chromen-6-yl)amino]prop-2-enenitrile
Catalog ID
STK537676
SMILES N#C/C(=C\Nc1ccc2c(c1)ccc(=O)o2)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]
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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 C21H12N4O4S MW 416.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N4O4S/c22-10-15(11-23-16-4-7-19-14(9-16)3-8-20(26)29-19)21-24-18(12-30-21)13-1-5-17(6-2-13)25(27)28/h1-9,11-12,23H/b15-11+InChIKey
AKFDROQTDVGTNA-RVDMUPIBSA-NSynonyms
(2E)2(4(4nitrophenyl)13thiazol2yl)3((2oxo2Hchromen6yl)amino)prop2enenitrile
(E)2(4(4NITROPHENYL)13THIAZOL2YL)3((2OXOCHROMEN6YL)AMINO)PROP2ENENITRILE
(E)2(4(4nitrophenyl)thiazol2yl)3((2oxo2Hchromen6yl)amino)acrylonitrile
C1=CC(=CC=C1C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N)(N+)(=O)(O)
InChI=1SC21H12N4O4Sc221015(112316471914(916)3820(26)2919)212418(123021)131517(6213)25(27)28h19111223Hb1511+
MFCD02983703
N#CC(=CNc1ccc2c(c1)ccc(=O)o2)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000001831087
ZINC01831087
ZINC1831087
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