Vitas-M small molecule compound
(2Z)-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(phenylamino)prop-2-enenitrile
Catalog ID
STK834774
SMILES N#C/C(=C/Nc1ccccc1)/c1scc(n1)c1cc2cc(ccc2oc1=O)[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/c22-10-14(11-23-15-4-2-1-3-5-15)20-24-18(12-30-20)17-9-13-8-16(25(27)28)6-7-19(13)29-21(17)26/h1-9,11-12,23H/b14-11-InChIKey
YTBGOSNVEGCJKY-KAMYIIQDSA-NSynonyms
372501-30-9(2Z)2(4(6nitro2oxo2Hchromen3yl)13thiazol2yl)3(phenylamino)prop2enenitrile
(Z)2(4(6nitro2oxo2Hchromen3yl)thiazol2yl)3(phenylamino)acrylonitrile
(Z)3ANILINO2(4(6NITRO2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
372501309
C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
InChI=1SC21H12N4O4Sc221014(1123154213515)202418(123020)17913816(25(27)28)6719(13)2921(17)26h19111223Hb1411
MFCD01944563
N#CC(=CNc1ccccc1)c1scc(n1)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
ZINC000016671821
ZINC16671821
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