N-(hexadecylcarbamothioyl)-4-phenethyloxy-benzamide

Systemtic Name: N-(hexadecylcarbamothioyl)-4-phenethyloxy-benzamide Openeye Name: N-(hexadecylcarbamothioyl)-4-phenethyloxy-benzamide CAS Name: N-[(hexadecylamino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-(hexadecylcarbamothioyl)-4-phenethyloxybenzamide Traditional Name: N-(cetylthiocarbamoyl)-4-phenethyloxy-benzamide Formula: C32H48N2O2S MolecularWeight: 524.80072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=C(C=C1)OCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=S)NC(=O)C1=CC=C(C=C1)OCCC2=CC=CC=C2

InChI

InChI=1S/C32H48N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-26-33-32(37)34-31(35)29-21-23-30(24-22-29)36-27-25-28-19-16-15-17-20-28/h15-17,19-24H,2-14,18,25-27H2,1H3,(H2,33,34,35,37)