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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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