2-(4-azanylcyclohexyl)-9-propan-2-yl-6-[(4-thiophen-3-ylphenyl)methyl]-1,3-dihydropurine-2,6-diamine

Systemtic Name: 2-(4-azanylcyclohexyl)-9-propan-2-yl-6-[(4-thiophen-3-ylphenyl)methyl]-1,3-dihydropurine-2,6-diamine Openeye Name: 2-(4-aminocyclohexyl)-9-isopropyl-6-[[4-(3-thienyl)phenyl]methyl]-1,3-dihydropurine-2,6-diamine CAS Name: 2-(4-aminocyclohexyl)-9-propan-2-yl-6-[[4-(3-thiophenyl)phenyl]methyl]-1,3-dihydropurine-2,6-diamine IUPAC Name: 2-(4-aminocyclohexyl)-9-propan-2-yl-6-[(4-thiophen-3-ylphenyl)methyl]-1,3-dihydropurine-2,6-diamine Traditional Name: [2-amino-2-(4-aminocyclohexyl)-9-isopropyl-6-[4-(3-thienyl)benzyl]-1,3-dihydropurin-6-yl]amine Formula: C25H35N7S MolecularWeight: 465.6573

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1NC(NC2(CC3=CC=C(C=C3)C4=CSC=C4)N)(C5CCC(CC5)N)N

Isomeric SMILES

CC(C)N1C=NC2=C1NC(NC2(CC3=CC=C(C=C3)C4=CSC=C4)N)(C5CCC(CC5)N)N

InChI

InChI=1S/C25H35N7S/c1-16(2)32-15-29-22-23(32)30-25(28,20-7-9-21(26)10-8-20)31-24(22,27)13-17-3-5-18(6-4-17)19-11-12-33-14-19/h3-6,11-12,14-16,20-21,30-31H,7-10,13,26-28H2,1-2H3