N-ethyl-2-[(6-oxidanylidene-9-phenyl-3H-purin-8-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-ethyl-2-[(6-oxidanylidene-9-phenyl-3H-purin-8-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-ethyl-2-[(6-oxo-9-phenyl-3H-purin-8-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-ethyl-2-[(6-oxo-9-phenyl-3H-purin-8-yl)thio]-N-phenylacetamide IUPAC Name: N-ethyl-2-[(6-oxo-9-phenyl-3H-purin-8-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-ethyl-2-[(6-keto-9-phenyl-3H-purin-8-yl)thio]-N-phenyl-acetamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(N2C4=CC=CC=C4)NC=NC3=O

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(N2C4=CC=CC=C4)NC=NC3=O

InChI

InChI=1S/C21H19N5O2S/c1-2-25(15-9-5-3-6-10-15)17(27)13-29-21-24-18-19(22-14-23-20(18)28)26(21)16-11-7-4-8-12-16/h3-12,14H,2,13H2,1H3,(H,22,23,28)