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

Systemtic Name: 4-[(3-chloranyl-4-phenoxy-phenyl)amino]-7-[5-[(pyridin-4-ylmethylamino)methyl]thiophen-3-yl]quinoline-3-carbonitrile Openeye Name: 4-(3-chloro-4-phenoxy-anilino)-7-[5-[(4-pyridylmethylamino)methyl]-3-thienyl]quinoline-3-carbonitrile CAS Name: 4-(3-chloro-4-phenoxyanilino)-7-[5-[(pyridin-4-ylmethylamino)methyl]-3-thiophenyl]-3-quinolinecarbonitrile IUPAC Name: 4-(3-chloro-4-phenoxyanilino)-7-[5-[(pyridin-4-ylmethylamino)methyl]thiophen-3-yl]quinoline-3-carbonitrile Traditional Name: 4-(3-chloro-4-phenoxy-anilino)-7-[5-[(4-pyridylmethylamino)methyl]-3-thienyl]quinoline-3-carbonitrile Formula: C33H24ClN5OS MolecularWeight: 574.09456

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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=CSC(=C5)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=CSC(=C5)CNCC6=CC=NC=C6)Cl

InChI

InChI=1S/C33H24ClN5OS/c34-30-16-26(7-9-32(30)40-27-4-2-1-3-5-27)39-33-25(17-35)19-38-31-15-23(6-8-29(31)33)24-14-28(41-21-24)20-37-18-22-10-12-36-13-11-22/h1-16,19,21,37H,18,20H2,(H,38,39)