6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-7-pyrrolidin-1-yl-pteridin-4-amine

Systemtic Name: 6-chloranyl-N-(phenylmethyl)-2-piperazin-1-yl-7-pyrrolidin-1-yl-pteridin-4-amine Openeye Name: N-benzyl-6-chloro-2-piperazin-1-yl-7-pyrrolidin-1-yl-pteridin-4-amine CAS Name: 6-chloro-N-(phenylmethyl)-2-(1-piperazinyl)-7-(1-pyrrolidinyl)-4-pteridinamine IUPAC Name: N-benzyl-6-chloro-2-piperazin-1-yl-7-pyrrolidin-1-ylpteridin-4-amine Traditional Name: benzyl-(6-chloro-2-piperazino-7-pyrrolidino-pteridin-4-yl)amine Formula: C21H25ClN8 MolecularWeight: 424.9298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C(=NC(=N3)N4CCNCC4)NCC5=CC=CC=C5)N=C2Cl

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C(=NC(=N3)N4CCNCC4)NCC5=CC=CC=C5)N=C2Cl

InChI

InChI=1S/C21H25ClN8/c22-17-20(29-10-4-5-11-29)26-19-16(25-17)18(24-14-15-6-2-1-3-7-15)27-21(28-19)30-12-8-23-9-13-30/h1-3,6-7,23H,4-5,8-14H2,(H,24,26,27,28)