N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]-4-[2-methoxyethyl(methyl)amino]but-2-ynamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]-4-[2-methoxyethyl(methyl)amino]but-2-ynamide Openeye Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-4-[2-methoxyethyl(methyl)amino]but-2-ynamide CAS Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolinyl]-4-[2-methoxyethyl(methyl)amino]-2-butynamide IUPAC Name: N-[4-(3-bromoanilino)-3-cyanoquinolin-6-yl]-4-[2-methoxyethyl(methyl)amino]but-2-ynamide Traditional Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-4-[2-methoxyethyl(methyl)amino]but-2-ynamide Formula: C24H22BrN5O2 MolecularWeight: 492.36778

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC)CC#CC(=O)NC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=CC=C3)Br

Isomeric SMILES

CN(CCOC)CC#CC(=O)NC1=CC2=C(C(=CN=C2C=C1)C#N)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C24H22BrN5O2/c1-30(11-12-32-2)10-4-7-23(31)28-20-8-9-22-21(14-20)24(17(15-26)16-27-22)29-19-6-3-5-18(25)13-19/h3,5-6,8-9,13-14,16H,10-12H2,1-2H3,(H,27,29)(H,28,31)