9-[2-[(phenylmethyl)amino]ethyl]-8-thiophen-2-yl-purin-6-amine

Systemtic Name: 9-[2-[(phenylmethyl)amino]ethyl]-8-thiophen-2-yl-purin-6-amine Openeye Name: 9-[2-(benzylamino)ethyl]-8-(2-thienyl)purin-6-amine CAS Name: 9-[2-[(phenylmethyl)amino]ethyl]-8-thiophen-2-yl-6-purinamine IUPAC Name: 9-[2-(benzylamino)ethyl]-8-thiophen-2-ylpurin-6-amine Traditional Name: 2-[6-amino-8-(2-thienyl)purin-9-yl]ethyl-benzyl-amine Formula: C18H18N6S MolecularWeight: 350.44072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCN2C3=C(C(=NC=N3)N)N=C2C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CNCCN2C3=C(C(=NC=N3)N)N=C2C4=CC=CS4

InChI

InChI=1S/C18H18N6S/c19-16-15-18(22-12-21-16)24(17(23-15)14-7-4-10-25-14)9-8-20-11-13-5-2-1-3-6-13/h1-7,10,12,20H,8-9,11H2,(H2,19,21,22)