2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-methoxyphenyl)pteridin-4-amine

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-methoxyphenyl)pteridin-4-amine Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-methoxyphenyl)pteridin-4-amine CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-N-(4-methoxyphenyl)-4-pteridinamine IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]-N-(4-methoxyphenyl)pteridin-4-amine Traditional Name: [2-[4-(3-chlorophenyl)piperazino]pteridin-4-yl]-(4-methoxyphenyl)amine Formula: C23H22ClN7O MolecularWeight: 447.92008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC3=NC=CN=C32)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC3=NC=CN=C32)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C23H22ClN7O/c1-32-19-7-5-17(6-8-19)27-22-20-21(26-10-9-25-20)28-23(29-22)31-13-11-30(12-14-31)18-4-2-3-16(24)15-18/h2-10,15H,11-14H2,1H3,(H,26,27,28,29)