5-[4-[(4-chlorophenyl)methylamino]phenyl]-6-phenethyl-pyrimidine-2,4-diamine

Systemtic Name: 5-[4-[(4-chlorophenyl)methylamino]phenyl]-6-phenethyl-pyrimidine-2,4-diamine Openeye Name: 5-[4-[(4-chlorophenyl)methylamino]phenyl]-6-phenethyl-pyrimidine-2,4-diamine CAS Name: 5-[4-[(4-chlorophenyl)methylamino]phenyl]-6-phenethylpyrimidine-2,4-diamine IUPAC Name: 5-[4-[(4-chlorophenyl)methylamino]phenyl]-6-phenethylpyrimidine-2,4-diamine Traditional Name: (4-chlorobenzyl)-[4-(2,4-diamino-6-phenethyl-pyrimidin-5-yl)phenyl]amine Formula: C25H24ClN5 MolecularWeight: 429.94456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C(=NC(=N2)N)N)C3=CC=C(C=C3)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClN5/c26-20-11-6-18(7-12-20)16-29-21-13-9-19(10-14-21)23-22(30-25(28)31-24(23)27)15-8-17-4-2-1-3-5-17/h1-7,9-14,29H,8,15-16H2,(H4,27,28,30,31)