N6-tert-butyl-N2-(2-methyl-1-benzothiophen-5-yl)-7H-purine-2,6,8-triamine

Systemtic Name: N6-tert-butyl-N2-(2-methyl-1-benzothiophen-5-yl)-7H-purine-2,6,8-triamine Openeye Name: N6-tert-butyl-N2-(2-methylbenzothiophen-5-yl)-7H-purine-2,6,8-triamine CAS Name: N6-tert-butyl-N2-(2-methyl-1-benzothiophen-5-yl)-7H-purine-2,6,8-triamine IUPAC Name: 6-N-tert-butyl-2-N-(2-methyl-1-benzothiophen-5-yl)-7H-purine-2,6,8-triamine Traditional Name: [8-amino-6-(tert-butylamino)-7H-purin-2-yl]-(2-methylbenzothiophen-5-yl)amine Formula: C18H21N7S MolecularWeight: 367.47124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)C=CC(=C2)NC3=NC4=C(C(=N3)NC(C)(C)C)NC(=N4)N

Isomeric SMILES

CC1=CC2=C(S1)C=CC(=C2)NC3=NC4=C(C(=N3)NC(C)(C)C)NC(=N4)N

InChI

InChI=1S/C18H21N7S/c1-9-7-10-8-11(5-6-12(10)26-9)20-17-23-14-13(21-16(19)22-14)15(24-17)25-18(2,3)4/h5-8H,1-4H3,(H5,19,20,21,22,23,24,25)