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

Systemtic Name: 2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-2-methyl-propane-1,3-diol Openeye Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-2-methyl-propane-1,3-diol CAS Name: 2-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]amino]-2-methylpropane-1,3-diol IUPAC Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)amino]-2-methylpropane-1,3-diol Traditional Name: 2-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)amino]-2-methyl-propane-1,3-diol Formula: C18H27ClN8O2 MolecularWeight: 422.91238

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC1=NC2=C(C(=NC(=N2)N3CCNCC3)N4CCCC4)N=C1Cl

Isomeric SMILES

CC(CO)(CO)NC1=NC2=C(C(=NC(=N2)N3CCNCC3)N4CCCC4)N=C1Cl

InChI

InChI=1S/C18H27ClN8O2/c1-18(10-28,11-29)25-15-13(19)21-12-14(22-15)23-17(27-8-4-20-5-9-27)24-16(12)26-6-2-3-7-26/h20,28-29H,2-11H2,1H3,(H,22,23,24,25)