4-[(3-chloranyl-4-phenoxy-phenyl)amino]-7-[5-[(pyridin-4-ylmethylamino)methyl]furan-2-yl]quinoline-3-carbonitrile

Systemtic Name: 4-[(3-chloranyl-4-phenoxy-phenyl)amino]-7-[5-[(pyridin-4-ylmethylamino)methyl]furan-2-yl]quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-phenoxy-anilino)-7-[5-[(4-pyridylmethylamino)methyl]-2-furyl]quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-phenoxyanilino)-7-[5-[(pyridin-4-ylmethylamino)methyl]-2-furanyl]-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-phenoxyanilino)-7-[5-[(pyridin-4-ylmethylamino)methyl]furan-2-yl]quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-phenoxy-anilino)-7-[5-[(4-pyridylmethylamino)methyl]-2-furyl]quinoline-3-carbonitrile Formula: C33H24ClN5O2 MolecularWeight: 558.02896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C(C=C2)NC3=C4C=CC(=CC4=NC=C3C#N)C5=CC=C(O5)CNCC6=CC=NC=C6)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C(C=C2)NC3=C4C=CC(=CC4=NC=C3C#N)C5=CC=C(O5)CNCC6=CC=NC=C6)Cl

InChI

InChI=1S/C33H24ClN5O2/c34-29-17-25(7-10-32(29)40-26-4-2-1-3-5-26)39-33-24(18-35)20-38-30-16-23(6-9-28(30)33)31-11-8-27(41-31)21-37-19-22-12-14-36-15-13-22/h1-17,20,37H,19,21H2,(H,38,39)