N-[[4-[3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]methyl]ethanamide

Systemtic Name: N-[[4-[3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]methyl]ethanamide Openeye Name: N-[[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]methyl]acetamide CAS Name: N-[[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]methyl]acetamide IUPAC Name: N-[[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]methyl]acetamide Traditional Name: N-[4-[3-(2-amino-4-keto-6-phenyl-1H-pyrimidin-5-yl)propylamino]benzyl]acetamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)NCCCC2=C(NC(=NC2=O)N)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)NCCCC2=C(NC(=NC2=O)N)C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2/c1-15(28)25-14-16-9-11-18(12-10-16)24-13-5-8-19-20(17-6-3-2-4-7-17)26-22(23)27-21(19)29/h2-4,6-7,9-12,24H,5,8,13-14H2,1H3,(H,25,28)(H3,23,26,27,29)