N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: N-(2,6-dibromo-4-isopropyl-phenyl)-4-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: N-(2,6-dibromo-4-propan-2-ylphenyl)-4-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(2,6-dibromo-4-propan-2-ylphenyl)-4-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: N-(2,6-dibromo-4-isopropyl-phenyl)-4-(2-pyrimidyl)piperazine-1-carboxamide Formula: C18H21Br2N5O MolecularWeight: 483.20024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCN(CC2)C3=NC=CC=N3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCN(CC2)C3=NC=CC=N3)Br

InChI

InChI=1S/C18H21Br2N5O/c1-12(2)13-10-14(19)16(15(20)11-13)23-18(26)25-8-6-24(7-9-25)17-21-4-3-5-22-17/h3-5,10-12H,6-9H2,1-2H3,(H,23,26)