3-[[4-[(4-naphthalen-1-yloxyphenyl)amino]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-[(4-naphthalen-1-yloxyphenyl)amino]pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-[4-(1-naphthyloxy)anilino]pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-[4-(1-naphthalenyloxy)anilino]-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(4-naphthalen-1-yloxyanilino)pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-[4-(1-naphthoxy)anilino]pyrimidin-2-yl]amino]benzamide Formula: C27H21N5O2 MolecularWeight: 447.48794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OC3=CC=C(C=C3)NC4=NC(=NC=C4)NC5=CC=CC(=C5)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OC3=CC=C(C=C3)NC4=NC(=NC=C4)NC5=CC=CC(=C5)C(=O)N

InChI

InChI=1S/C27H21N5O2/c28-26(33)19-7-3-8-21(17-19)31-27-29-16-15-25(32-27)30-20-11-13-22(14-12-20)34-24-10-4-6-18-5-1-2-9-23(18)24/h1-17H,(H2,28,33)(H2,29,30,31,32)