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

Systemtic Name: 2-[(9-ethyl-6-oxidanylidene-3H-purin-8-yl)sulfanyl]-N-phenyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(9-ethyl-6-oxo-3H-purin-8-yl)thio]-N-phenyl-N-prop-2-enylacetamide IUPAC Name: 2-[(9-ethyl-6-oxo-3H-purin-8-yl)sulfanyl]-N-phenyl-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[(9-ethyl-6-keto-3H-purin-8-yl)thio]-N-phenyl-acetamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)N(CC=C)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C(=O)N=CN2)N=C1SCC(=O)N(CC=C)C3=CC=CC=C3

InChI

InChI=1S/C18H19N5O2S/c1-3-10-23(13-8-6-5-7-9-13)14(24)11-26-18-21-15-16(22(18)4-2)19-12-20-17(15)25/h3,5-9,12H,1,4,10-11H2,2H3,(H,19,20,25)