3-[3-(ethanethioylamino)propyl]-N,N-diphenyl-1-benzofuran-5-carbothioamide

Systemtic Name: 3-[3-(ethanethioylamino)propyl]-N,N-diphenyl-1-benzofuran-5-carbothioamide Openeye Name: 3-[3-(ethanethioylamino)propyl]-N,N-diphenyl-benzofuran-5-carbothioamide CAS Name: N,N-diphenyl-3-[3-(1-sulfanylideneethylamino)propyl]-5-benzofurancarbothioamide IUPAC Name: 3-[3-(ethanethioylamino)propyl]-N,N-diphenyl-1-benzofuran-5-carbothioamide Traditional Name: N,N-diphenyl-3-[3-(thioacetylamino)propyl]benzofuran-5-carbothioamide Formula: C26H24N2OS2 MolecularWeight: 444.61156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCCCC1=COC2=C1C=C(C=C2)C(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=S)NCCCC1=COC2=C1C=C(C=C2)C(=S)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2OS2/c1-19(30)27-16-8-9-21-18-29-25-15-14-20(17-24(21)25)26(31)28(22-10-4-2-5-11-22)23-12-6-3-7-13-23/h2-7,10-15,17-18H,8-9,16H2,1H3,(H,27,30)