4-[[4-(furan-3-ylmethyl)phenyl]amino]-7-[(2-hydroxyethylamino)methyl]-2-pyridin-2-yl-quinoline-3-carbonitrile

Systemtic Name: 4-[[4-(furan-3-ylmethyl)phenyl]amino]-7-[(2-hydroxyethylamino)methyl]-2-pyridin-2-yl-quinoline-3-carbonitrile Openeye Name: 4-[4-(3-furylmethyl)anilino]-7-[(2-hydroxyethylamino)methyl]-2-(2-pyridyl)quinoline-3-carbonitrile CAS Name: 4-[4-(3-furanylmethyl)anilino]-7-[(2-hydroxyethylamino)methyl]-2-(2-pyridinyl)-3-quinolinecarbonitrile IUPAC Name: 4-[4-(furan-3-ylmethyl)anilino]-7-[(2-hydroxyethylamino)methyl]-2-pyridin-2-ylquinoline-3-carbonitrile Traditional Name: 4-[4-(3-furfuryl)anilino]-7-[(2-hydroxyethylamino)methyl]-2-(2-pyridyl)quinoline-3-carbonitrile Formula: C29H25N5O2 MolecularWeight: 475.5411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC3=C(C=CC(=C3)CNCCO)C(=C2C#N)NC4=CC=C(C=C4)CC5=COC=C5

Isomeric SMILES

C1=CC=NC(=C1)C2=NC3=C(C=CC(=C3)CNCCO)C(=C2C#N)NC4=CC=C(C=C4)CC5=COC=C5

InChI

InChI=1S/C29H25N5O2/c30-17-25-28(33-23-7-4-20(5-8-23)15-22-10-14-36-19-22)24-9-6-21(18-31-12-13-35)16-27(24)34-29(25)26-3-1-2-11-32-26/h1-11,14,16,19,31,35H,12-13,15,18H2,(H,33,34)