2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]ethanamide Openeye Name: 2-(2-bromo-4-cyano-6-ethoxy-phenoxy)-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]acetamide CAS Name: 2-(2-bromo-4-cyano-6-ethoxyphenoxy)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]acetamide IUPAC Name: 2-(2-bromo-4-cyano-6-ethoxyphenoxy)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide Traditional Name: 2-(2-bromo-4-cyano-6-ethoxy-phenoxy)-N-[4-(isopropylcarbamoylamino)benzyl]acetamide Formula: C22H25BrN4O4 MolecularWeight: 489.3623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)NCC2=CC=C(C=C2)NC(=O)NC(C)C

InChI

InChI=1S/C22H25BrN4O4/c1-4-30-19-10-16(11-24)9-18(23)21(19)31-13-20(28)25-12-15-5-7-17(8-6-15)27-22(29)26-14(2)3/h5-10,14H,4,12-13H2,1-3H3,(H,25,28)(H2,26,27,29)