N2-(4-azanylcyclohexyl)-9-propan-2-yl-N6-[(5-thiophen-3-ylthiophen-2-yl)methyl]purine-2,6-diamine hydrochloride

Systemtic Name: N2-(4-azanylcyclohexyl)-9-propan-2-yl-N6-[(5-thiophen-3-ylthiophen-2-yl)methyl]purine-2,6-diamine hydrochloride Openeye Name: N2-(4-aminocyclohexyl)-9-isopropyl-N6-[[5-(3-thienyl)-2-thienyl]methyl]purine-2,6-diamine hydrochloride CAS Name: N2-(4-aminocyclohexyl)-9-propan-2-yl-N6-[[5-(3-thiophenyl)-2-thiophenyl]methyl]purine-2,6-diamine hydrochloride IUPAC Name: 2-N-(4-aminocyclohexyl)-9-propan-2-yl-6-N-[(5-thiophen-3-ylthiophen-2-yl)methyl]purine-2,6-diamine hydrochloride Traditional Name: (4-aminocyclohexyl)-[9-isopropyl-6-[[5-(3-thienyl)-2-thienyl]methylamino]purin-2-yl]amine hydrochloride Formula: C23H30ClN7S2 MolecularWeight: 504.1142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(S3)C4=CSC=C4)NC5CCC(CC5)N.Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(S3)C4=CSC=C4)NC5CCC(CC5)N.Cl

InChI

InChI=1S/C23H29N7S2.ClH/c1-14(2)30-13-26-20-21(25-11-18-7-8-19(32-18)15-9-10-31-12-15)28-23(29-22(20)30)27-17-5-3-16(24)4-6-17;/h7-10,12-14,16-17H,3-6,11,24H2,1-2H3,(H2,25,27,28,29);1H