Vitas-M small molecule compound
(2E)-N-{[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK184381
SMILES S=C(Nc1ccc2c(c1)nc(o2)c1ccccc1Cl)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 C23H15ClN4O4S MW 478.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClN4O4S/c24-18-7-2-1-6-17(18)22-26-19-13-15(9-10-20(19)32-22)25-23(33)27-21(29)11-8-14-4-3-5-16(12-14)28(30)31/h1-13H,(H2,25,27,29,33)/b11-8+InChIKey
UWNGDEMCLNOOIK-DHZHZOJOSA-NSynonyms
(2E)N(((2(2CHLOROPHENYL)BENZOXAZOL5YL)AMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(2E)N((2(2CHLOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((2(2CHLOROPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C=CC4=CC(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC23H15ClN4O4Sc2418721617(18)2226191315(91020(19)3222)2523(33)2721(29)1181443516(1214)28(30)31h113H(H225272933)b118+
MFCD03037522
S=C(Nc1ccc2c(c1)nc(o2)c1ccccc1Cl)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000004091001
ZINC04091001
ZINC4091001
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