(2R)-2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-2-phenyl-ethanamide Openeye Name: (2R)-2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-2-phenyl-acetamide CAS Name: (2R)-2-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]amino]-2-phenylacetamide IUPAC Name: (2R)-2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)amino]-2-phenylacetamide Traditional Name: (2R)-2-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)amino]-2-phenyl-acetamide Formula: C22H26ClN9O MolecularWeight: 467.95454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)NC(C4=CC=CC=C4)C(=O)N)Cl)N5CCNCC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2N=C(C(=N3)N[C@H](C4=CC=CC=C4)C(=O)N)Cl)N5CCNCC5

InChI

InChI=1S/C22H26ClN9O/c23-17-20(27-15(18(24)33)14-6-2-1-3-7-14)28-19-16(26-17)21(31-10-4-5-11-31)30-22(29-19)32-12-8-25-9-13-32/h1-3,6-7,15,25H,4-5,8-13H2,(H2,24,33)(H,27,28,29,30)/t15-/m1/s1