Vitas-M small molecule compound
(2E)-N-(6-chloro-2-phenyl-2H-benzotriazol-5-yl)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide
Catalog ID
STK240307
SMILES O=C(Nc1cc2nn(nc2cc1Cl)c1ccccc1)/C=C/c1ccc(o1)c1ccccc1[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 C25H16ClN5O4 MW 485.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN5O4/c26-19-14-21-22(29-30(28-21)16-6-2-1-3-7-16)15-20(19)27-25(32)13-11-17-10-12-24(35-17)18-8-4-5-9-23(18)31(33)34/h1-15H,(H,27,32)/b13-11+InChIKey
LOLNBSYDSIOBRF-ACCUITESSA-NSynonyms
(2E)N(6chloro2phenyl2Hbenzotriazol5yl)3(5(2nitrophenyl)furan2yl)prop2enamide
(E)N(6CHLORO2PHENYLBENZOTRIAZOL5YL)3(5(2NITROPHENYL)FURAN2YL)PROP2ENAMIDE
C1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=O)C=CC4=CC=C(O4)C5=CC=CC=C5(N+)(=O)(O)
InChI=1SC25H16ClN5O4c2619142122(2930(2821)166213716)1520(19)2725(32)131117101224(3517)18845923(18)31(33)34h115H(H2732)b1311+
MFCD05819615
O=C(Nc1cc2nn(nc2cc1Cl)c1ccccc1)C=Cc1ccc(o1)c1ccccc1(N+)(=O)(O)
ZINC000009226423
ZINC09226423
ZINC9226423
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