N-(heptylcarbamothioyl)-3-phenethyloxy-benzamide

Systemtic Name: N-(heptylcarbamothioyl)-3-phenethyloxy-benzamide Openeye Name: N-(heptylcarbamothioyl)-3-phenethyloxy-benzamide CAS Name: N-[(heptylamino)-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-(heptylcarbamothioyl)-3-phenethyloxybenzamide Traditional Name: N-(heptylthiocarbamoyl)-3-phenethyloxy-benzamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=CC(=CC=C1)OCCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=CC(=CC=C1)OCCC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O2S/c1-2-3-4-5-9-16-24-23(28)25-22(26)20-13-10-14-21(18-20)27-17-15-19-11-7-6-8-12-19/h6-8,10-14,18H,2-5,9,15-17H2,1H3,(H2,24,25,26,28)