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

Systemtic Name: 2-azanyl-3-[3,5-bis(bromanyl)-4-methyl-phenyl]-1-(4-pyridin-4-ylpiperazin-1-yl)propan-1-one Openeye Name: 2-amino-3-(3,5-dibromo-4-methyl-phenyl)-1-[4-(4-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 2-amino-3-(3,5-dibromo-4-methylphenyl)-1-(4-pyridin-4-yl-1-piperazinyl)-1-propanone IUPAC Name: 2-amino-3-(3,5-dibromo-4-methylphenyl)-1-(4-pyridin-4-ylpiperazin-1-yl)propan-1-one Traditional Name: 2-amino-3-(3,5-dibromo-4-methyl-phenyl)-1-[4-(4-pyridyl)piperazino]propan-1-one Formula: C19H22Br2N4O MolecularWeight: 482.21218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Br)CC(C(=O)N2CCN(CC2)C3=CC=NC=C3)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1Br)CC(C(=O)N2CCN(CC2)C3=CC=NC=C3)N)Br

InChI

InChI=1S/C19H22Br2N4O/c1-13-16(20)10-14(11-17(13)21)12-18(22)19(26)25-8-6-24(7-9-25)15-2-4-23-5-3-15/h2-5,10-11,18H,6-9,12,22H2,1H3