1-butyl-3-ethyl-7-(3-oxidanylidenebutyl)-6-sulfanylidene-purin-2-one

Systemtic Name: 1-butyl-3-ethyl-7-(3-oxidanylidenebutyl)-6-sulfanylidene-purin-2-one Openeye Name: 1-butyl-3-ethyl-7-(3-oxobutyl)-6-thioxo-purin-2-one CAS Name: 1-butyl-3-ethyl-7-(3-oxobutyl)-6-sulfanylidene-2-purinone IUPAC Name: 1-butyl-3-ethyl-7-(3-oxobutyl)-6-sulfanylidenepurin-2-one Traditional Name: 1-butyl-3-ethyl-7-(3-ketobutyl)-6-thioxo-purin-2-one Formula: C15H22N4O2S MolecularWeight: 322.42578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=S)C2=C(N=CN2CCC(=O)C)N(C1=O)CC

Isomeric SMILES

CCCCN1C(=S)C2=C(N=CN2CCC(=O)C)N(C1=O)CC

InChI

InChI=1S/C15H22N4O2S/c1-4-6-8-19-14(22)12-13(18(5-2)15(19)21)16-10-17(12)9-7-11(3)20/h10H,4-9H2,1-3H3