N2,N4-bis(3-chlorophenyl)-6-(4-phenylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2,N4-bis(3-chlorophenyl)-6-(4-phenylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine Openeye Name: N2,N4-bis(3-chlorophenyl)-6-(4-phenylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine CAS Name: N2,N4-bis(3-chlorophenyl)-6-(4-phenyl-1-piperazinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N,4-N-bis(3-chlorophenyl)-6-(4-phenylpiperazin-1-yl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-(3-chloroanilino)-6-(4-phenylpiperazino)-s-triazin-2-yl]-(3-chlorophenyl)amine Formula: C25H23Cl2N7 MolecularWeight: 492.40302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC(=NC(=N3)NC4=CC(=CC=C4)Cl)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC(=NC(=N3)NC4=CC(=CC=C4)Cl)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H23Cl2N7/c26-18-6-4-8-20(16-18)28-23-30-24(29-21-9-5-7-19(27)17-21)32-25(31-23)34-14-12-33(13-15-34)22-10-2-1-3-11-22/h1-11,16-17H,12-15H2,(H2,28,29,30,31,32)