7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-[(2,4-dimethylphenyl)amino]quinoline-3-carbonitrile

Systemtic Name: 7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-[(2,4-dimethylphenyl)amino]quinoline-3-carbonitrile Openeye Name: 7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-(2,4-dimethylanilino)quinoline-3-carbonitrile CAS Name: 7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-(2,4-dimethylanilino)-3-quinolinecarbonitrile IUPAC Name: 7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-(2,4-dimethylanilino)quinoline-3-carbonitrile Traditional Name: 7-[4-[(2-dimethylaminoethylamino)methyl]phenyl]-4-(2,4-dimethylanilino)quinoline-3-carbonitrile Formula: C29H31N5 MolecularWeight: 449.58994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(C=C4)CNCCN(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(C=C4)CNCCN(C)C)C

InChI

InChI=1S/C29H31N5/c1-20-5-12-27(21(2)15-20)33-29-25(17-30)19-32-28-16-24(10-11-26(28)29)23-8-6-22(7-9-23)18-31-13-14-34(3)4/h5-12,15-16,19,31H,13-14,18H2,1-4H3,(H,32,33)