2-(4-azanylbutylamino)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(4-azanylbutylamino)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(4-aminobutylamino)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(4-aminobutylamino)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(4-aminobutylamino)-5-[(4-fluorophenyl)methyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(4-aminobutylamino)-5-(4-fluorobenzyl)-6-methyl-1H-pyrimidin-4-one Formula: C16H21FN4O MolecularWeight: 304.362543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NCCCCN)CC2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NCCCCN)CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H21FN4O/c1-11-14(10-12-4-6-13(17)7-5-12)15(22)21-16(20-11)19-9-3-2-8-18/h4-7H,2-3,8-10,18H2,1H3,(H2,19,20,21,22)