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

Systemtic Name: N-[4-[(4-methyl-6-phenylazanyl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-butanamide Openeye Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-butanamide CAS Name: N-[4-[(4-anilino-6-methyl-2-pyrimidinyl)amino]phenyl]-4-phenylbutanamide IUPAC Name: N-[4-[(4-anilino-6-methylpyrimidin-2-yl)amino]phenyl]-4-phenylbutanamide Traditional Name: N-[4-[(4-anilino-6-methyl-pyrimidin-2-yl)amino]phenyl]-4-phenyl-butyramide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)CCCC3=CC=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)CCCC3=CC=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O/c1-20-19-25(29-22-12-6-3-7-13-22)32-27(28-20)31-24-17-15-23(16-18-24)30-26(33)14-8-11-21-9-4-2-5-10-21/h2-7,9-10,12-13,15-19H,8,11,14H2,1H3,(H,30,33)(H2,28,29,31,32)