N-phenyl-6-propylsulfanyl-purine-9-carboxamide

Systemtic Name: N-phenyl-6-propylsulfanyl-purine-9-carboxamide Openeye Name: N-phenyl-6-propylsulfanyl-purine-9-carboxamide CAS Name: N-phenyl-6-(propylthio)-9-purinecarboxamide IUPAC Name: N-phenyl-6-propylsulfanylpurine-9-carboxamide Traditional Name: N-phenyl-6-(propylthio)purine-9-carboxamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=NC2=C1N=CN2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCSC1=NC=NC2=C1N=CN2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C15H15N5OS/c1-2-8-22-14-12-13(16-9-17-14)20(10-18-12)15(21)19-11-6-4-3-5-7-11/h3-7,9-10H,2,8H2,1H3,(H,19,21)