N-(hexadecylcarbamothioyl)-2-methoxy-benzamide

Systemtic Name: N-(hexadecylcarbamothioyl)-2-methoxy-benzamide Openeye Name: N-(hexadecylcarbamothioyl)-2-methoxy-benzamide CAS Name: N-[(hexadecylamino)-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: N-(hexadecylcarbamothioyl)-2-methoxybenzamide Traditional Name: N-(cetylthiocarbamoyl)-2-methoxy-benzamide Formula: C25H42N2O2S MolecularWeight: 434.67818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=CC=C1OC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=CC=C1OC

InChI

InChI=1S/C25H42N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-26-25(30)27-24(28)22-19-16-17-20-23(22)29-2/h16-17,19-20H,3-15,18,21H2,1-2H3,(H2,26,27,28,30)