4-[4-(aminomethyl)piperidin-1-yl]-N-(3-bromophenyl)-5-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: 4-[4-(aminomethyl)piperidin-1-yl]-N-(3-bromophenyl)-5-(trifluoromethyl)pyrimidin-2-amine Openeye Name: 4-[4-(aminomethyl)-1-piperidyl]-N-(3-bromophenyl)-5-(trifluoromethyl)pyrimidin-2-amine CAS Name: 4-[4-(aminomethyl)-1-piperidinyl]-N-(3-bromophenyl)-5-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: 4-[4-(aminomethyl)piperidin-1-yl]-N-(3-bromophenyl)-5-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [4-[4-(aminomethyl)piperidino]-5-(trifluoromethyl)pyrimidin-2-yl]-(3-bromophenyl)amine Formula: C17H19BrF3N5 MolecularWeight: 430.26547

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=NC(=NC=C2C(F)(F)F)NC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCC1CN)C2=NC(=NC=C2C(F)(F)F)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H19BrF3N5/c18-12-2-1-3-13(8-12)24-16-23-10-14(17(19,20)21)15(25-16)26-6-4-11(9-22)5-7-26/h1-3,8,10-11H,4-7,9,22H2,(H,23,24,25)