6-chloranyl-2-piperazin-1-yl-N-(pyridin-3-ylmethyl)-4-pyrrolidin-1-yl-pteridin-7-amine

Systemtic Name: 6-chloranyl-2-piperazin-1-yl-N-(pyridin-3-ylmethyl)-4-pyrrolidin-1-yl-pteridin-7-amine Openeye Name: 6-chloro-2-piperazin-1-yl-N-(3-pyridylmethyl)-4-pyrrolidin-1-yl-pteridin-7-amine CAS Name: 6-chloro-2-(1-piperazinyl)-N-(3-pyridinylmethyl)-4-(1-pyrrolidinyl)-7-pteridinamine IUPAC Name: 6-chloro-2-piperazin-1-yl-N-(pyridin-3-ylmethyl)-4-pyrrolidin-1-ylpteridin-7-amine Traditional Name: (6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)-(3-pyridylmethyl)amine Formula: C20H24ClN9 MolecularWeight: 425.91786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CN=CC=C4)Cl)N5CCNCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NCC4=CN=CC=C4)Cl)N5CCNCC5

InChI

InChI=1S/C20H24ClN9/c21-16-18(24-13-14-4-3-5-23-12-14)26-17-15(25-16)19(29-8-1-2-9-29)28-20(27-17)30-10-6-22-7-11-30/h3-5,12,22H,1-2,6-11,13H2,(H,24,26,27,28)