4-[4-[[4-(4-propylpiperazin-1-yl)phenyl]amino]quinolin-6-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[[4-(4-propylpiperazin-1-yl)phenyl]amino]quinolin-6-yl]benzenecarbonitrile Openeye Name: 4-[4-[4-(4-propylpiperazin-1-yl)anilino]-6-quinolyl]benzonitrile CAS Name: 4-[4-[4-(4-propyl-1-piperazinyl)anilino]-6-quinolinyl]benzonitrile IUPAC Name: 4-[4-[4-(4-propylpiperazin-1-yl)anilino]quinolin-6-yl]benzonitrile Traditional Name: 4-[4-[4-(4-propylpiperazino)anilino]-6-quinolyl]benzonitrile Formula: C29H29N5 MolecularWeight: 447.57406

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3)C5=CC=C(C=C5)C#N

Isomeric SMILES

CCCN1CCN(CC1)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H29N5/c1-2-15-33-16-18-34(19-17-33)26-10-8-25(9-11-26)32-29-13-14-31-28-12-7-24(20-27(28)29)23-5-3-22(21-30)4-6-23/h3-14,20H,2,15-19H2,1H3,(H,31,32)