N2-(2-naphthalen-2-ylpteridin-4-yl)adamantane-2,4-diamine

Systemtic Name: N2-(2-naphthalen-2-ylpteridin-4-yl)adamantane-2,4-diamine Openeye Name: N2-[2-(2-naphthyl)pteridin-4-yl]adamantane-2,4-diamine CAS Name: N2-[2-(2-naphthalenyl)-4-pteridinyl]adamantane-2,4-diamine IUPAC Name: 2-N-(2-naphthalen-2-ylpteridin-4-yl)adamantane-2,4-diamine Traditional Name: (4-amino-2-adamantyl)-[2-(2-naphthyl)pteridin-4-yl]amine Formula: C26H26N6 MolecularWeight: 422.52484

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1C(C(C2)C3NC4=NC(=NC5=NC=CN=C54)C6=CC7=CC=CC=C7C=C6)N

Isomeric SMILES

C1C2CC3CC1C(C(C2)C3NC4=NC(=NC5=NC=CN=C54)C6=CC7=CC=CC=C7C=C6)N

InChI

InChI=1S/C26H26N6/c27-21-18-9-14-10-19(13-18)22(20(21)11-14)30-26-23-25(29-8-7-28-23)31-24(32-26)17-6-5-15-3-1-2-4-16(15)12-17/h1-8,12,14,18-22H,9-11,13,27H2,(H,29,30,31,32)