3-ethoxy-N-[(4-heptoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-ethoxy-N-[(4-heptoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-ethoxy-N-[(4-heptoxyphenyl)carbamothioyl]benzamide CAS Name: 3-ethoxy-N-[(4-heptoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-ethoxy-N-[(4-heptoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-ethoxy-N-[(4-heptoxyphenyl)thiocarbamoyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

InChI

InChI=1S/C23H30N2O3S/c1-3-5-6-7-8-16-28-20-14-12-19(13-15-20)24-23(29)25-22(26)18-10-9-11-21(17-18)27-4-2/h9-15,17H,3-8,16H2,1-2H3,(H2,24,25,26,29)