2-azanyl-3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-(4-pyridin-4-ylpiperidin-1-yl)propan-1-one

Systemtic Name: 2-azanyl-3-[4-azanyl-3,5-bis(bromanyl)phenyl]-1-(4-pyridin-4-ylpiperidin-1-yl)propan-1-one Openeye Name: 2-amino-3-(4-amino-3,5-dibromo-phenyl)-1-[4-(4-pyridyl)-1-piperidyl]propan-1-one CAS Name: 2-amino-3-(4-amino-3,5-dibromophenyl)-1-(4-pyridin-4-yl-1-piperidinyl)-1-propanone IUPAC Name: 2-amino-3-(4-amino-3,5-dibromophenyl)-1-(4-pyridin-4-ylpiperidin-1-yl)propan-1-one Traditional Name: 2-amino-3-(4-amino-3,5-dibromo-phenyl)-1-[4-(4-pyridyl)piperidino]propan-1-one Formula: C19H22Br2N4O MolecularWeight: 482.21218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=NC=C2)C(=O)C(CC3=CC(=C(C(=C3)Br)N)Br)N

Isomeric SMILES

C1CN(CCC1C2=CC=NC=C2)C(=O)C(CC3=CC(=C(C(=C3)Br)N)Br)N

InChI

InChI=1S/C19H22Br2N4O/c20-15-9-12(10-16(21)18(15)23)11-17(22)19(26)25-7-3-14(4-8-25)13-1-5-24-6-2-13/h1-2,5-6,9-10,14,17H,3-4,7-8,11,22-23H2