Vitas-M small molecule compound

(2E)-2-cyano-N-(3,4-dimethylphenyl)-3-(4-hydroxy-3-iodophenyl)prop-2-enamide

Catalog ID
STK119461
SMILES N#C/C(=C\c1ccc(c(c1)I)O)/C(=O)Nc1ccc(c(c1)C)C

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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 C18H15IN2O2 MW 418.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15IN2O2/c1-11-3-5-15(7-12(11)2)21-18(23)14(10-20)8-13-4-6-17(22)16(19)9-13/h3-9,22H,1-2H3,(H,21,23)/b14-8+
InChIKey
PUBSPTAOEYCNSN-RIYZIHGNSA-N
Synonyms

(2E)2CYANON(34DIMETHYLPHENYL)3(4HYDROXY3IODOPHENYL)PROP2ENAMIDE
(E)2CYANON(34DIMETHYLPHENYL)3(4HYDROXY3IODOPHENYL)PROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)O)I)C#N)C
InChI=1SC18H15IN2O2c1113515(712(11)2)2118(23)14(1020)8134617(22)16(19)913h3922H12H3(H2123)b148+
MFCD08680119
N#CC(=Cc1ccc(c(c1)I)O)C(=O)Nc1ccc(c(c1)C)C
ZINC000001410761
ZINC01410761
ZINC1410761

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Available files

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