3-butan-2-yloxy-N-(hexadecylcarbamothioyl)benzamide

Systemtic Name: 3-butan-2-yloxy-N-(hexadecylcarbamothioyl)benzamide Openeye Name: N-(hexadecylcarbamothioyl)-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[(hexadecylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butan-2-yloxy-N-(hexadecylcarbamothioyl)benzamide Traditional Name: N-(cetylthiocarbamoyl)-3-sec-butoxy-benzamide Formula: C28H48N2O2S MolecularWeight: 476.75792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H48N2O2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-29-28(33)30-27(31)25-20-19-21-26(23-25)32-24(3)5-2/h19-21,23-24H,4-18,22H2,1-3H3,(H2,29,30,31,33)