N2-(4-azanylcyclohexyl)-N6-propyl-9-(thiolan-3-yl)purine-2,6-diamine

Systemtic Name: N2-(4-azanylcyclohexyl)-N6-propyl-9-(thiolan-3-yl)purine-2,6-diamine Openeye Name: N2-(4-aminocyclohexyl)-N6-propyl-9-tetrahydrothiophen-3-yl-purine-2,6-diamine CAS Name: N2-(4-aminocyclohexyl)-N6-propyl-9-(3-thiolanyl)purine-2,6-diamine IUPAC Name: 2-N-(4-aminocyclohexyl)-6-N-propyl-9-(thiolan-3-yl)purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[6-(propylamino)-9-tetrahydrothiophen-3-yl-purin-2-yl]amine Formula: C18H29N7S MolecularWeight: 375.53476

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC2=C1N=CN2C3CCSC3)NC4CCC(CC4)N

Isomeric SMILES

CCCNC1=NC(=NC2=C1N=CN2C3CCSC3)NC4CCC(CC4)N

InChI

InChI=1S/C18H29N7S/c1-2-8-20-16-15-17(25(11-21-15)14-7-9-26-10-14)24-18(23-16)22-13-5-3-12(19)4-6-13/h11-14H,2-10,19H2,1H3,(H2,20,22,23,24)