2-bromanyl-N-[2-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]ethyl]benzamide

Systemtic Name: 2-bromanyl-N-[2-[(3-cyano-6,8-dimethyl-quinolin-2-yl)amino]ethyl]benzamide Openeye Name: 2-bromo-N-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]benzamide CAS Name: 2-bromo-N-[2-[(3-cyano-6,8-dimethyl-2-quinolinyl)amino]ethyl]benzamide IUPAC Name: 2-bromo-N-[2-[(3-cyano-6,8-dimethylquinolin-2-yl)amino]ethyl]benzamide Traditional Name: 2-bromo-N-[2-[(3-cyano-6,8-dimethyl-2-quinolyl)amino]ethyl]benzamide Formula: C21H19BrN4O MolecularWeight: 423.30576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCNC(=O)C3=CC=CC=C3Br)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C=C(C(=N2)NCCNC(=O)C3=CC=CC=C3Br)C#N)C

InChI

InChI=1S/C21H19BrN4O/c1-13-9-14(2)19-15(10-13)11-16(12-23)20(26-19)24-7-8-25-21(27)17-5-3-4-6-18(17)22/h3-6,9-11H,7-8H2,1-2H3,(H,24,26)(H,25,27)