N-[[4-[(dibutylamino)methyl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-[(dibutylamino)methyl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[4-[(dibutylamino)methyl]phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[4-[(dibutylamino)methyl]anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[4-[(dibutylamino)methyl]phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[4-[(dibutylamino)methyl]phenyl]thiocarbamoyl]coumarilamide Formula: C25H31N3O2S MolecularWeight: 437.59754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCN(CCCC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C25H31N3O2S/c1-3-5-15-28(16-6-4-2)18-19-11-13-21(14-12-19)26-25(31)27-24(29)23-17-20-9-7-8-10-22(20)30-23/h7-14,17H,3-6,15-16,18H2,1-2H3,(H2,26,27,29,31)