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

Systemtic Name: 8-(2-bromophenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-(2-bromophenyl)-3-propyl-6-thioxo-7H-purin-2-one CAS Name: 8-(2-bromophenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-(2-bromophenyl)-3-propyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-(2-bromophenyl)-3-propyl-6-thioxo-7H-purin-2-one Formula: C14H13BrN4OS MolecularWeight: 365.24822

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3Br

Isomeric SMILES

CCCN1C2=C(C(=S)NC1=O)NC(=N2)C3=CC=CC=C3Br

InChI

InChI=1S/C14H13BrN4OS/c1-2-7-19-12-10(13(21)18-14(19)20)16-11(17-12)8-5-3-4-6-9(8)15/h3-6H,2,7H2,1H3,(H,16,17)(H,18,20,21)