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

Systemtic Name: 2-[(6-chloranyl-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-1-phenyl-ethanol Openeye Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-yl)amino]-1-phenyl-ethanol CAS Name: 2-[[6-chloro-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinyl]amino]-1-phenylethanol IUPAC Name: 2-[(6-chloro-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-yl)amino]-1-phenylethanol Traditional Name: 2-[(6-chloro-2-piperazino-4-pyrrolidino-pteridin-7-yl)amino]-1-phenyl-ethanol Formula: C22H27ClN8O MolecularWeight: 454.95578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN8O/c23-18-20(25-14-16(32)15-6-2-1-3-7-15)27-19-17(26-18)21(30-10-4-5-11-30)29-22(28-19)31-12-8-24-9-13-31/h1-3,6-7,16,24,32H,4-5,8-14H2,(H,25,27,28,29)