7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one

Systemtic Name: 7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Openeye Name: 7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one CAS Name: 7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one IUPAC Name: 7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Traditional Name: 7-phenyl-1-propyl-5H-pyrimido[1,2-a][1,4]benzodiazepin-3-one Formula: C21H19N3O MolecularWeight: 329.39506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C2N1C3=CC=CC=C3C(=NC2)C4=CC=CC=C4

Isomeric SMILES

CCCC1=CC(=O)N=C2N1C3=CC=CC=C3C(=NC2)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O/c1-2-8-16-13-20(25)23-19-14-22-21(15-9-4-3-5-10-15)17-11-6-7-12-18(17)24(16)19/h3-7,9-13H,2,8,14H2,1H3