2-[1-[2-azanylethyl-[(4-bromophenyl)methyl]amino]propyl]-3-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 2-[1-[2-azanylethyl-[(4-bromophenyl)methyl]amino]propyl]-3-(phenylmethyl)pyrimidin-4-one Openeye Name: 2-[1-[2-aminoethyl-[(4-bromophenyl)methyl]amino]propyl]-3-benzyl-pyrimidin-4-one CAS Name: 2-[1-[2-aminoethyl-[(4-bromophenyl)methyl]amino]propyl]-3-(phenylmethyl)-4-pyrimidinone IUPAC Name: 2-[1-[2-aminoethyl-[(4-bromophenyl)methyl]amino]propyl]-3-benzylpyrimidin-4-one Traditional Name: 2-[1-[2-aminoethyl-(4-bromobenzyl)amino]propyl]-3-benzyl-pyrimidin-4-one Formula: C23H27BrN4O MolecularWeight: 455.39068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=CC(=O)N1CC2=CC=CC=C2)N(CCN)CC3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C1=NC=CC(=O)N1CC2=CC=CC=C2)N(CCN)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C23H27BrN4O/c1-2-21(27(15-13-25)16-19-8-10-20(24)11-9-19)23-26-14-12-22(29)28(23)17-18-6-4-3-5-7-18/h3-12,14,21H,2,13,15-17,25H2,1H3