8-(1,3-benzothiazol-2-yl)-9-(2-methylpropyl)purine-2,6-diamine

Systemtic Name: 8-(1,3-benzothiazol-2-yl)-9-(2-methylpropyl)purine-2,6-diamine Openeye Name: 8-(1,3-benzothiazol-2-yl)-9-isobutyl-purine-2,6-diamine CAS Name: 8-(1,3-benzothiazol-2-yl)-9-(2-methylpropyl)purine-2,6-diamine IUPAC Name: 8-(1,3-benzothiazol-2-yl)-9-(2-methylpropyl)purine-2,6-diamine Traditional Name: [2-amino-8-(1,3-benzothiazol-2-yl)-9-isobutyl-purin-6-yl]amine Formula: C16H17N7S MolecularWeight: 339.41808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=NC(=N2)N)N)N=C1C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CN1C2=C(C(=NC(=N2)N)N)N=C1C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H17N7S/c1-8(2)7-23-13-11(12(17)21-16(18)22-13)20-14(23)15-19-9-5-3-4-6-10(9)24-15/h3-6,8H,7H2,1-2H3,(H4,17,18,21,22)