N-(furan-2-ylmethylcarbamothioyl)-4-heptyl-benzamide

Systemtic Name: N-(furan-2-ylmethylcarbamothioyl)-4-heptyl-benzamide Openeye Name: N-(2-furylmethylcarbamothioyl)-4-heptyl-benzamide CAS Name: N-[(2-furanylmethylamino)-sulfanylidenemethyl]-4-heptylbenzamide IUPAC Name: N-(furan-2-ylmethylcarbamothioyl)-4-heptylbenzamide Traditional Name: N-(2-furfurylthiocarbamoyl)-4-heptyl-benzamide Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C20H26N2O2S/c1-2-3-4-5-6-8-16-10-12-17(13-11-16)19(23)22-20(25)21-15-18-9-7-14-24-18/h7,9-14H,2-6,8,15H2,1H3,(H2,21,22,23,25)