Vitas-M small molecule compound
(2E)-3-[5-(2-bromo-4-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enethioamide
Catalog ID
STL376664
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1Br)[N+](=O)[O-])/C(=S)N
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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 C14H8BrN3O3S MW 378.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H8BrN3O3S/c15-12-6-9(18(19)20)1-3-11(12)13-4-2-10(21-13)5-8(7-16)14(17)22/h1-6H,(H2,17,22)/b8-5+InChIKey
YVWDKHUXUJYABQ-VMPITWQZSA-NSynonyms
(2E)3(5(2bromo4nitrophenyl)furan2yl)2cyanoprop2enethioamide
(E)3(5(2BROMO4NITROPHENYL)FURAN2YL)2CYANOPROP2ENETHIOAMIDE
C1=CC(=C(C=C1(N+)(=O)(O))Br)C2=CC=C(O2)C=C(C#N)C(=S)N
InChI=1SC14H8BrN3O3Sc151269(18(19)20)1311(12)134210(2113)58(716)14(17)22h16H(H21722)b85+
MFCD06628745
N#CC(=Cc1ccc(o1)c1ccc(cc1Br)(N+)(=O)(O))C(=S)N
ZINC000002881951
ZINC02881951
ZINC2881951
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