N4-(2-bromophenyl)-5-nitro-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(2-bromophenyl)-5-nitro-N6-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Openeye Name: N4-(2-bromophenyl)-5-nitro-N6-[2-(1-piperidyl)ethyl]pyrimidine-4,6-diamine CAS Name: N4-(2-bromophenyl)-5-nitro-N6-[2-(1-piperidinyl)ethyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-(2-bromophenyl)-5-nitro-6-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine Traditional Name: [6-(2-bromoanilino)-5-nitro-pyrimidin-4-yl]-(2-piperidinoethyl)amine Formula: C17H21BrN6O2 MolecularWeight: 421.29164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3Br

Isomeric SMILES

C1CCN(CC1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3Br

InChI

InChI=1S/C17H21BrN6O2/c18-13-6-2-3-7-14(13)22-17-15(24(25)26)16(20-12-21-17)19-8-11-23-9-4-1-5-10-23/h2-3,6-7,12H,1,4-5,8-11H2,(H2,19,20,21,22)