Vitas-M small molecule compound
N-[4-({[(2E)-3-(3-nitrophenyl)prop-2-enoyl]carbamothioyl}amino)phenyl]furan-2-carboxamide
Catalog ID
STK023408
SMILES S=C(Nc1ccc(cc1)NC(=O)c1ccco1)NC(=O)/C=C/c1cccc(c1)[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 C21H16N4O5S MW 436.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O5S/c26-19(11-6-14-3-1-4-17(13-14)25(28)29)24-21(31)23-16-9-7-15(8-10-16)22-20(27)18-5-2-12-30-18/h1-13H,(H,22,27)(H2,23,24,26,31)/b11-6+InChIKey
KWNHGCFDLWNRHU-IZZDOVSWSA-NSynonyms
(2E)N(((4(2FURYLCARBONYLAMINO)PHENYL)AMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CO3
InChI=1SC21H16N4O5Sc2619(1161431417(1314)25(28)29)2421(31)23169715(81016)2220(27)1852123018h113H(H2227)(H223242631)b116+
MFCD03037510
N(4((((2E)3(3NITROPHENYL)PROP2ENOYL)CARBAMOTHIOYL)AMINO)PHENYL)FURAN2CARBOXAMIDE
N(4(((E)3(3NITROPHENYL)PROP2ENOYL)CARBAMOTHIOYLAMINO)PHENYL)FURAN2CARBOXAMIDE
S=C(Nc1ccc(cc1)NC(=O)c1ccco1)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
STK023408
ZINC000004090989
ZINC04090989
ZINC4090989
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