N2-(5-chloranyl-2-methyl-phenyl)-6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(5-chloranyl-2-methyl-phenyl)-6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-benzhydrylpiperazin-1-yl)methyl]-N2-(5-chloro-2-methyl-phenyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(5-chloro-2-methylphenyl)-6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-benzhydrylpiperazin-1-yl)methyl]-2-N-(5-chloro-2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-benzhydrylpiperazino)methyl]-s-triazin-2-yl]-(5-chloro-2-methyl-phenyl)amine Formula: C28H30ClN7 MolecularWeight: 500.0377

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC2=NC(=NC(=N2)N)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC2=NC(=NC(=N2)N)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H30ClN7/c1-20-12-13-23(29)18-24(20)31-28-33-25(32-27(30)34-28)19-35-14-16-36(17-15-35)26(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,26H,14-17,19H2,1H3,(H3,30,31,32,33,34)