4-[2-azanyl-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N-ethyl-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-azanyl-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N-ethyl-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N-ethyl-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)-4-pteridinyl]-N-ethyl-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N-ethyl-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N-ethyl-N-phenyl-piperazine-1-carboxamide Formula: C27H30N8O3 MolecularWeight: 514.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=NC=C(N=C43)C5=CC(=C(C=C5)OC)OC)N

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=NC=C(N=C43)C5=CC(=C(C=C5)OC)OC)N

InChI

InChI=1S/C27H30N8O3/c1-4-35(19-8-6-5-7-9-19)27(36)34-14-12-33(13-15-34)25-23-24(31-26(28)32-25)29-17-20(30-23)18-10-11-21(37-2)22(16-18)38-3/h5-11,16-17H,4,12-15H2,1-3H3,(H2,28,29,31,32)