N2-(1-benzothiophen-6-yl)-N6-tert-butyl-7H-purine-2,6-diamine

Systemtic Name: N2-(1-benzothiophen-6-yl)-N6-tert-butyl-7H-purine-2,6-diamine Openeye Name: N2-(benzothiophen-6-yl)-N6-tert-butyl-7H-purine-2,6-diamine CAS Name: N2-(1-benzothiophen-6-yl)-N6-tert-butyl-7H-purine-2,6-diamine IUPAC Name: 2-N-(1-benzothiophen-6-yl)-6-N-tert-butyl-7H-purine-2,6-diamine Traditional Name: benzothiophen-6-yl-[6-(tert-butylamino)-7H-purin-2-yl]amine Formula: C17H18N6S MolecularWeight: 338.43002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC4=C(C=C3)C=CS4

Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC4=C(C=C3)C=CS4

InChI

InChI=1S/C17H18N6S/c1-17(2,3)23-15-13-14(19-9-18-13)21-16(22-15)20-11-5-4-10-6-7-24-12(10)8-11/h4-9H,1-3H3,(H3,18,19,20,21,22,23)