(2S)-1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(6-methoxynaphthalen-2-yl)propan-1-one

Systemtic Name: (2S)-1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(6-methoxynaphthalen-2-yl)propan-1-one Openeye Name: (2S)-1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(6-methoxy-2-naphthyl)propan-1-one CAS Name: (2S)-1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-2-(6-methoxy-2-naphthalenyl)-1-propanone IUPAC Name: (2S)-1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(6-methoxynaphthalen-2-yl)propan-1-one Traditional Name: (2S)-1-[4-(5-bromopyrimidin-2-yl)piperazino]-2-(6-methoxy-2-naphthyl)propan-1-one Formula: C22H23BrN4O2 MolecularWeight: 455.34762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br

InChI

InChI=1S/C22H23BrN4O2/c1-15(16-3-4-18-12-20(29-2)6-5-17(18)11-16)21(28)26-7-9-27(10-8-26)22-24-13-19(23)14-25-22/h3-6,11-15H,7-10H2,1-2H3/t15-/m0/s1