N-(4-chloranyl-2-methyl-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]pteridin-4-amine

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]pteridin-4-amine Openeye Name: N-(4-chloro-2-methyl-phenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]pteridin-4-amine CAS Name: N-(4-chloro-2-methylphenyl)-2-[4-(4-fluorophenyl)-1-piperazinyl]-4-pteridinamine IUPAC Name: N-(4-chloro-2-methylphenyl)-2-[4-(4-fluorophenyl)piperazin-1-yl]pteridin-4-amine Traditional Name: (4-chloro-2-methyl-phenyl)-[2-[4-(4-fluorophenyl)piperazino]pteridin-4-yl]amine Formula: C23H21ClFN7 MolecularWeight: 449.911143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=NC(=NC3=NC=CN=C32)N4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=NC(=NC3=NC=CN=C32)N4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C23H21ClFN7/c1-15-14-16(24)2-7-19(15)28-22-20-21(27-9-8-26-20)29-23(30-22)32-12-10-31(11-13-32)18-5-3-17(25)4-6-18/h2-9,14H,10-13H2,1H3,(H,27,28,29,30)