Vitas-M small molecule compound
(2E)-3-[(3-nitrophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK528349
SMILES N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1cc2ccccc2oc1=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/c22-10-14(11-23-15-5-3-6-16(9-15)25(27)28)20-24-18(12-30-20)17-8-13-4-1-2-7-19(13)29-21(17)26/h1-9,11-12,23H/b14-11+InChIKey
RPAPNLQSYUHEIN-SDNWHVSQSA-NSynonyms
373374-15-3(2E)3((3nitrophenyl)amino)2(4(2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3((3nitrophenyl)amino)2(4(2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(3NITROANILINO)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
373374153
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CSC(=N3)C(=CNC4=CC(=CC=C4)(N+)(=O)(O))C#N
InChI=1SC21H12N4O4Sc221014(11231553616(915)25(27)28)202418(123020)17813412719(13)2921(17)26h19111223Hb1411+
MFCD01946289
N#CC(=CNc1cccc(c1)(N+)(=O)(O))c1scc(n1)c1cc2ccccc2oc1=O
ZINC000001740693
ZINC01740693
ZINC1740693
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