Vitas-M small molecule compound
N-(2,2,2-trichloro-1-{[(4-methoxy-3-nitrophenyl)carbamothioyl]amino}ethyl)furan-2-carboxamide
Catalog ID
STK369358
SMILES COc1ccc(cc1[N+](=O)[O-])NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)c1ccco1
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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 C15H13Cl3N4O5S MW 467.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13Cl3N4O5S/c1-26-10-5-4-8(7-9(10)22(24)25)19-14(28)21-13(15(16,17)18)20-12(23)11-3-2-6-27-11/h2-7,13H,1H3,(H,20,23)(H2,19,21,28)InChIKey
GIPCVEGRWIJFCM-UHFFFAOYSA-NSynonyms
2FURYLN(222TRICHLORO1((((4METHOXY3NITROPHENYL)AMINO)THIOXOMETHYL)AMINO)ETHYL)CARBOXAMIDE
COC1=C(C=C(C=C1)NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C2=CC=CO2)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)c1ccco1
InChI=1SC15H13Cl3N4O5Sc12610548(79(10)22(24)25)1914(28)2113(15(1617)18)2012(23)113262711h2713H1H3(H2023)(H2192128)
MFCD00268051
N(222trichloro1(((4methoxy3nitrophenyl)carbamothioyl)amino)ethyl)furan2carboxamide
N(222TRICHLORO1((4METHOXY3NITROPHENYL)CARBAMOTHIOYLAMINO)ETHYL)FURAN2CARBOXAMIDE
ZINC000003137245
ZINC000003137246
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