N2-(3-chlorophenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(3-chlorophenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(3-chlorophenyl)-6-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(3-chlorophenyl)-6-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(3-chlorophenyl)-6-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[4-(2-pyridyl)piperazino]methyl]-s-triazin-2-yl]-(3-chlorophenyl)amine Formula: C19H21ClN8 MolecularWeight: 396.87664

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NC(=N2)NC3=CC(=CC=C3)Cl)N)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=NC(=NC(=N2)NC3=CC(=CC=C3)Cl)N)C4=CC=CC=N4

InChI

InChI=1S/C19H21ClN8/c20-14-4-3-5-15(12-14)23-19-25-16(24-18(21)26-19)13-27-8-10-28(11-9-27)17-6-1-2-7-22-17/h1-7,12H,8-11,13H2,(H3,21,23,24,25,26)