N2-(1,3-benzothiazol-5-yl)-N6-tert-butyl-7H-purine-2,6-diamine

Systemtic Name: N2-(1,3-benzothiazol-5-yl)-N6-tert-butyl-7H-purine-2,6-diamine Openeye Name: N2-(1,3-benzothiazol-5-yl)-N6-tert-butyl-7H-purine-2,6-diamine CAS Name: N2-(1,3-benzothiazol-5-yl)-N6-tert-butyl-7H-purine-2,6-diamine IUPAC Name: 2-N-(1,3-benzothiazol-5-yl)-6-N-tert-butyl-7H-purine-2,6-diamine Traditional Name: 1,3-benzothiazol-5-yl-[6-(tert-butylamino)-7H-purin-2-yl]amine Formula: C16H17N7S MolecularWeight: 339.41808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC4=C(C=C3)SC=N4

Isomeric SMILES

CC(C)(C)NC1=NC(=NC2=C1NC=N2)NC3=CC4=C(C=C3)SC=N4

InChI

InChI=1S/C16H17N7S/c1-16(2,3)23-14-12-13(18-7-17-12)21-15(22-14)20-9-4-5-11-10(6-9)19-8-24-11/h4-8H,1-3H3,(H3,17,18,20,21,22,23)