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

Systemtic Name: 6-methoxy-N-(phenylmethyl)-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-amine Openeye Name: N-benzyl-6-methoxy-2-piperazin-1-yl-4-pyrrolidin-1-yl-pteridin-7-amine CAS Name: 6-methoxy-N-(phenylmethyl)-2-(1-piperazinyl)-4-(1-pyrrolidinyl)-7-pteridinamine IUPAC Name: N-benzyl-6-methoxy-2-piperazin-1-yl-4-pyrrolidin-1-ylpteridin-7-amine Traditional Name: benzyl-(6-methoxy-2-piperazino-4-pyrrolidino-pteridin-7-yl)amine Formula: C22H28N8O MolecularWeight: 420.51072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(N=C1NCC3=CC=CC=C3)N=C(N=C2N4CCCC4)N5CCNCC5

Isomeric SMILES

COC1=NC2=C(N=C1NCC3=CC=CC=C3)N=C(N=C2N4CCCC4)N5CCNCC5

InChI

InChI=1S/C22H28N8O/c1-31-21-19(24-15-16-7-3-2-4-8-16)26-18-17(25-21)20(29-11-5-6-12-29)28-22(27-18)30-13-9-23-10-14-30/h2-4,7-8,23H,5-6,9-15H2,1H3,(H,24,26,27,28)