5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(4-butylphenyl)iminomethyl]-1-(4-fluorophenyl)barbituric acid Formula: C21H20FN3O3 MolecularWeight: 381.400203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N=CC2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)N=CC2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-2-3-4-14-5-9-16(10-6-14)23-13-18-19(26)24-21(28)25(20(18)27)17-11-7-15(22)8-12-17/h5-13,18H,2-4H2,1H3,(H,24,26,28)