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

Systemtic Name: N-(furan-2-ylmethylcarbamothioyl)-4-heptoxy-benzamide Openeye Name: N-(2-furylmethylcarbamothioyl)-4-heptoxy-benzamide CAS Name: N-[(2-furanylmethylamino)-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-(furan-2-ylmethylcarbamothioyl)-4-heptoxybenzamide Traditional Name: N-(2-furfurylthiocarbamoyl)-4-heptoxy-benzamide Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C20H26N2O3S/c1-2-3-4-5-6-13-24-17-11-9-16(10-12-17)19(23)22-20(26)21-15-18-8-7-14-25-18/h7-12,14H,2-6,13,15H2,1H3,(H2,21,22,23,26)