aluminum; benzenethiolate; 2-methanidylpropane

Systemtic Name: aluminum; benzenethiolate; 2-methanidylpropane Openeye Name: aluminum; benzenethiolate; 2-methanidylpropane CAS Name: aluminum; benzenethiolate; 2-methanidylpropane IUPAC Name: aluminum; benzenethiolate; 2-methanidylpropane Traditional Name: aluminum; benzenethiolate; 2-methanidylpropane Formula: C14H23AlS MolecularWeight: 250.378958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[CH2-].CC(C)[CH2-].C1=CC=C(C=C1)[S-].[Al+3]

Isomeric SMILES

CC(C)[CH2-].CC(C)[CH2-].C1=CC=C(C=C1)[S-].[Al+3]

InChI

InChI=1S/C6H6S.2C4H9.Al/c7-6-4-2-1-3-5-6;2*1-4(2)3;/h1-5,7H;2*4H,1H2,2-3H3;/q;2*-1;+3/p-1