N-[4-[(4-methyl-6-phenylazanyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-carboxamide

Systemtic Name: N-[4-[(4-methyl-6-phenylazanyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-carboxamide Openeye Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]naphthalene-2-carboxamide CAS Name: N-[4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl]-2-naphthalenecarboxamide IUPAC Name: N-[4-[(4-anilino-6-methylpyrimidin-2-yl)amino]phenyl]naphthalene-2-carboxamide Traditional Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]-2-naphthamide Formula: C28H23N5O MolecularWeight: 445.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC4=CC=CC=C4C=C3)NC5=CC=CC=C5

InChI

InChI=1S/C28H23N5O/c1-19-17-26(30-23-9-3-2-4-10-23)33-28(29-19)32-25-15-13-24(14-16-25)31-27(34)22-12-11-20-7-5-6-8-21(20)18-22/h2-18H,1H3,(H,31,34)(H2,29,30,32,33)