8-(2-azanylpyrimidin-4-yl)-9-cyclopropyl-N-(2-thiophen-2-ylethyl)purin-2-amine

Systemtic Name: 8-(2-azanylpyrimidin-4-yl)-9-cyclopropyl-N-(2-thiophen-2-ylethyl)purin-2-amine Openeye Name: 8-(2-aminopyrimidin-4-yl)-9-cyclopropyl-N-[2-(2-thienyl)ethyl]purin-2-amine CAS Name: 8-(2-amino-4-pyrimidinyl)-9-cyclopropyl-N-(2-thiophen-2-ylethyl)-2-purinamine IUPAC Name: 8-(2-aminopyrimidin-4-yl)-9-cyclopropyl-N-(2-thiophen-2-ylethyl)purin-2-amine Traditional Name: [8-(2-aminopyrimidin-4-yl)-9-cyclopropyl-purin-2-yl]-[2-(2-thienyl)ethyl]amine Formula: C18H18N8S MolecularWeight: 378.45412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NC3=CN=C(N=C32)NCCC4=CC=CS4)C5=NC(=NC=C5)N

Isomeric SMILES

C1CC1N2C(=NC3=CN=C(N=C32)NCCC4=CC=CS4)C5=NC(=NC=C5)N

InChI

InChI=1S/C18H18N8S/c19-17-20-8-6-13(24-17)15-23-14-10-22-18(21-7-5-12-2-1-9-27-12)25-16(14)26(15)11-3-4-11/h1-2,6,8-11H,3-5,7H2,(H2,19,20,24)(H,21,22,25)