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

Systemtic Name: 4-[(2,4-dimethylphenyl)amino]-7-[4-[(pyridin-4-ylamino)methyl]phenyl]quinoline-3-carbonitrile Openeye Name: 4-(2,4-dimethylanilino)-7-[4-[(4-pyridylamino)methyl]phenyl]quinoline-3-carbonitrile CAS Name: 4-(2,4-dimethylanilino)-7-[4-[(pyridin-4-ylamino)methyl]phenyl]-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dimethylanilino)-7-[4-[(pyridin-4-ylamino)methyl]phenyl]quinoline-3-carbonitrile Traditional Name: 4-(2,4-dimethylanilino)-7-[4-[(4-pyridylamino)methyl]phenyl]quinoline-3-carbonitrile Formula: C30H25N5 MolecularWeight: 455.553

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)CNC5=CC=NC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(C=C4)CNC5=CC=NC=C5)C

InChI

InChI=1S/C30H25N5/c1-20-3-10-28(21(2)15-20)35-30-25(17-31)19-34-29-16-24(8-9-27(29)30)23-6-4-22(5-7-23)18-33-26-11-13-32-14-12-26/h3-16,19H,18H2,1-2H3,(H,32,33)(H,34,35)