4-heptoxy-N-(heptylcarbamothioyl)benzamide

Systemtic Name: 4-heptoxy-N-(heptylcarbamothioyl)benzamide Openeye Name: 4-heptoxy-N-(heptylcarbamothioyl)benzamide CAS Name: 4-heptoxy-N-[(heptylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-(heptylcarbamothioyl)benzamide Traditional Name: 4-heptoxy-N-(heptylthiocarbamoyl)benzamide Formula: C22H36N2O2S MolecularWeight: 392.59844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=CC=C(C=C1)OCCCCCCC

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=CC=C(C=C1)OCCCCCCC

InChI

InChI=1S/C22H36N2O2S/c1-3-5-7-9-11-17-23-22(27)24-21(25)19-13-15-20(16-14-19)26-18-12-10-8-6-4-2/h13-16H,3-12,17-18H2,1-2H3,(H2,23,24,25,27)