6-methyl-5-pentyl-2-[(4-phenoxyphenyl)amino]-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-5-pentyl-2-[(4-phenoxyphenyl)amino]-1H-pyrimidin-4-one Openeye Name: 6-methyl-5-pentyl-2-(4-phenoxyanilino)-1H-pyrimidin-4-one CAS Name: 6-methyl-5-pentyl-2-(4-phenoxyanilino)-1H-pyrimidin-4-one IUPAC Name: 6-methyl-5-pentyl-2-(4-phenoxyanilino)-1H-pyrimidin-4-one Traditional Name: 5-amyl-6-methyl-2-(4-phenoxyanilino)-1H-pyrimidin-4-one Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(NC(=NC1=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CCCCCC1=C(NC(=NC1=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O2/c1-3-4-6-11-20-16(2)23-22(25-21(20)26)24-17-12-14-19(15-13-17)27-18-9-7-5-8-10-18/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H2,23,24,25,26)