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

Systemtic Name: 4-[2-azanyl-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N,N-di(propan-2-yl)piperazine-1-carboxamide Openeye Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N,N-diisopropyl-piperazine-1-carboxamide CAS Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)-4-pteridinyl]-N,N-di(propan-2-yl)-1-piperazinecarboxamide IUPAC Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N,N-di(propan-2-yl)piperazine-1-carboxamide Traditional Name: 4-[2-amino-6-(3,4-dimethoxyphenyl)pteridin-4-yl]-N,N-diisopropyl-piperazine-1-carboxamide Formula: C25H34N8O3 MolecularWeight: 494.58926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)N1CCN(CC1)C2=NC(=NC3=NC=C(N=C32)C4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CC(C)N(C(C)C)C(=O)N1CCN(CC1)C2=NC(=NC3=NC=C(N=C32)C4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C25H34N8O3/c1-15(2)33(16(3)4)25(34)32-11-9-31(10-12-32)23-21-22(29-24(26)30-23)27-14-18(28-21)17-7-8-19(35-5)20(13-17)36-6/h7-8,13-16H,9-12H2,1-6H3,(H2,26,27,29,30)