N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]-1-methyl-piperidine-3-carboxamide

Systemtic Name: N-[4-[(3-bromophenyl)amino]-3-cyano-quinolin-6-yl]-1-methyl-piperidine-3-carboxamide Openeye Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-1-methyl-piperidine-3-carboxamide CAS Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolinyl]-1-methyl-3-piperidinecarboxamide IUPAC Name: N-[4-(3-bromoanilino)-3-cyanoquinolin-6-yl]-1-methylpiperidine-3-carboxamide Traditional Name: N-[4-(3-bromoanilino)-3-cyano-6-quinolyl]-1-methyl-nipecotamide Formula: C23H22BrN5O MolecularWeight: 464.35768

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C(=O)NC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=CC=C4)Br

Isomeric SMILES

CN1CCCC(C1)C(=O)NC2=CC3=C(C(=CN=C3C=C2)C#N)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H22BrN5O/c1-29-9-3-4-15(14-29)23(30)28-19-7-8-21-20(11-19)22(16(12-25)13-26-21)27-18-6-2-5-17(24)10-18/h2,5-8,10-11,13,15H,3-4,9,14H2,1H3,(H,26,27)(H,28,30)