8-(2-propoxyphenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 8-(2-propoxyphenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-(2-propoxyphenyl)-3-propyl-6-thioxo-7H-purin-2-one CAS Name: 8-(2-propoxyphenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-(2-propoxyphenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-(2-propoxyphenyl)-3-propyl-6-thioxo-7H-purin-2-one Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3OCCC

Isomeric SMILES

CCCN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3OCCC

InChI

InChI=1S/C17H20N4O2S/c1-3-9-21-15-13(16(24)20-17(21)22)18-14(19-15)11-7-5-6-8-12(11)23-10-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,18,19)(H,20,22,24)