N-ethyl-8-(furan-2-yl)-9-phenyl-2-(3-phenylpropylsulfanyl)purin-6-amine

Systemtic Name: N-ethyl-8-(furan-2-yl)-9-phenyl-2-(3-phenylpropylsulfanyl)purin-6-amine Openeye Name: N-ethyl-8-(2-furyl)-9-phenyl-2-(3-phenylpropylsulfanyl)purin-6-amine CAS Name: N-ethyl-8-(2-furanyl)-9-phenyl-2-(3-phenylpropylthio)-6-purinamine IUPAC Name: N-ethyl-8-(furan-2-yl)-9-phenyl-2-(3-phenylpropylsulfanyl)purin-6-amine Traditional Name: ethyl-[8-(2-furyl)-9-phenyl-2-(3-phenylpropylthio)purin-6-yl]amine Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=C(N2C3=CC=CC=C3)C4=CC=CO4)SCCCC5=CC=CC=C5

Isomeric SMILES

CCNC1=NC(=NC2=C1N=C(N2C3=CC=CC=C3)C4=CC=CO4)SCCCC5=CC=CC=C5

InChI

InChI=1S/C26H25N5OS/c1-2-27-23-22-25(30-26(29-23)33-18-10-13-19-11-5-3-6-12-19)31(20-14-7-4-8-15-20)24(28-22)21-16-9-17-32-21/h3-9,11-12,14-17H,2,10,13,18H2,1H3,(H,27,29,30)