2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]propane-1,3-diol

Systemtic Name: 2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]propane-1,3-diol Openeye Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]propane-1,3-diol CAS Name: 2-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]amino]propane-1,3-diol IUPAC Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)amino]propane-1,3-diol Traditional Name: 2-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)amino]propane-1,3-diol Formula: C17H25ClN8O2 MolecularWeight: 408.8858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NC(CO)CO)Cl)N4CCNCC4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NC(CO)CO)Cl)N4CCNCC4

InChI

InChI=1S/C17H25ClN8O2/c18-13-15(20-11(9-27)10-28)22-14-12(21-13)16(25-5-1-2-6-25)24-17(23-14)26-7-3-19-4-8-26/h11,19,27-28H,1-10H2,(H,20,22,23,24)