5-(3-aminophenyl)-4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]pyridine-3-carbonitrile

Systemtic Name: 5-(3-aminophenyl)-4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]pyridine-3-carbonitrile Openeye Name: 5-(3-aminophenyl)-4-(4-benzyloxy-3-chloro-anilino)pyridine-3-carbonitrile CAS Name: 5-(3-aminophenyl)-4-(3-chloro-4-phenylmethoxyanilino)-3-pyridinecarbonitrile IUPAC Name: 5-(3-aminophenyl)-4-(3-chloro-4-phenylmethoxyanilino)pyridine-3-carbonitrile Traditional Name: 5-(3-aminophenyl)-4-(4-benzoxy-3-chloro-anilino)nicotinonitrile Formula: C25H19ClN4O MolecularWeight: 426.89756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=C(C=NC=C3C#N)C4=CC(=CC=C4)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=C(C=NC=C3C#N)C4=CC(=CC=C4)N)Cl

InChI

InChI=1S/C25H19ClN4O/c26-23-12-21(9-10-24(23)31-16-17-5-2-1-3-6-17)30-25-19(13-27)14-29-15-22(25)18-7-4-8-20(28)11-18/h1-12,14-15H,16,28H2,(H,29,30)