N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-4-hexoxy-benzamide

Systemtic Name: N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=S)NC(=O)C

InChI

InChI=1S/C23H28N4O3S2/c1-3-4-5-6-15-30-20-13-7-17(8-14-20)21(29)27-23(32)26-19-11-9-18(10-12-19)25-22(31)24-16(2)28/h7-14H,3-6,15H2,1-2H3,(H2,24,25,28,31)(H2,26,27,29,32)