N-(hexadecylcarbamothioyl)-2-(2-methylpropoxy)benzamide

Systemtic Name: N-(hexadecylcarbamothioyl)-2-(2-methylpropoxy)benzamide Openeye Name: N-(hexadecylcarbamothioyl)-2-isobutoxy-benzamide CAS Name: N-[(hexadecylamino)-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: N-(hexadecylcarbamothioyl)-2-(2-methylpropoxy)benzamide Traditional Name: N-(cetylthiocarbamoyl)-2-isobutoxy-benzamide Formula: C28H48N2O2S MolecularWeight: 476.75792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=CC=C1OCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=CC=C1OCC(C)C

InChI

InChI=1S/C28H48N2O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-29-28(33)30-27(31)25-20-17-18-21-26(25)32-23-24(2)3/h17-18,20-21,24H,4-16,19,22-23H2,1-3H3,(H2,29,30,31,33)