[butyl(ethyl)amino]-sulfaniumylidene-methanethiolate; iron(3+)

Systemtic Name: [butyl(ethyl)amino]-sulfaniumylidene-methanethiolate; iron(3+) Openeye Name: ferric [butyl(ethyl)amino]-sulfoniumylidene-methanethiolate CAS Name: [butyl(ethyl)amino]-sulfoniumylidenemethanethiolate; iron(3+) IUPAC Name: [butyl(ethyl)amino]-sulfoniumylidenemethanethiolate; iron(3+) Traditional Name: ferric [butyl(ethyl)amino]-sulfoniumylidene-methanethiolate Formula: C21H45FeN3S6+3 MolecularWeight: 587.8371

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=[SH+])[S-].CCCCN(CC)C(=[SH+])[S-].CCCCN(CC)C(=[SH+])[S-].[Fe+3]

Isomeric SMILES

CCCCN(CC)C(=[SH+])[S-].CCCCN(CC)C(=[SH+])[S-].CCCCN(CC)C(=[SH+])[S-].[Fe+3]

InChI

InChI=1S/3C7H15NS2.Fe/c3*1-3-5-6-8(4-2)7(9)10;/h3*3-6H2,1-2H3,(H,9,10);/q;;;+3