Vitas-M small molecule compound
4-{(1E)-2-cyano-3-[(4-iodophenyl)amino]-3-oxoprop-1-en-1-yl}phenyl benzoate
Catalog ID
STK379322
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccccc1)/C(=O)Nc1ccc(cc1)I
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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 C23H15IN2O3 MW 494.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15IN2O3/c24-19-8-10-20(11-9-19)26-22(27)18(15-25)14-16-6-12-21(13-7-16)29-23(28)17-4-2-1-3-5-17/h1-14H,(H,26,27)/b18-14+InChIKey
NUTUFLWNQXHQJH-NBVRZTHBSA-NSynonyms
(4((E)2CYANO3(4IODOANILINO)3OXOPROP1ENYL)PHENYL)BENZOATE
4((1E)2CYANO2(N(4IODOPHENYL)CARBAMOYL)VINYL)PHENYLBENZOATE
4((1E)2cyano3((4iodophenyl)amino)3oxoprop1en1yl)phenylbenzoate
C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)I
InChI=1SC23H15IN2O3c241981020(11919)2622(27)18(1525)141661221(13716)2923(28)174213517h114H(H2627)b1814+
MFCD02602734
N#CC(=Cc1ccc(cc1)OC(=O)c1ccccc1)C(=O)Nc1ccc(cc1)I
ZINC000016157797
ZINC16157797
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