N-(3-bromophenyl)-6-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(3-bromophenyl)-6-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine Openeye Name: N-(3-bromophenyl)-6-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine CAS Name: N-(3-bromophenyl)-6-[4-[(2,4-dichlorophenyl)methyl]-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-(3-bromophenyl)-6-[4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl]pyrimidin-4-amine Traditional Name: (3-bromophenyl)-[6-[4-(2,4-dichlorobenzyl)piperazino]pyrimidin-4-yl]amine Formula: C21H20BrCl2N5 MolecularWeight: 493.227

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)Cl)Cl)C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)Cl)Cl)C3=CC(=NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H20BrCl2N5/c22-16-2-1-3-18(10-16)27-20-12-21(26-14-25-20)29-8-6-28(7-9-29)13-15-4-5-17(23)11-19(15)24/h1-5,10-12,14H,6-9,13H2,(H,25,26,27)