3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[3-(propanoylamino)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[3-(propanoylamino)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-[(4-methylthiazol-2-yl)sulfanylmethyl]-N-[3-(propanoylamino)phenyl]benzofuran-2-carboxamide CAS Name: 3-[[(4-methyl-2-thiazolyl)thio]methyl]-N-[3-(1-oxopropylamino)phenyl]-2-benzofurancarboxamide IUPAC Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[3-(propanoylamino)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[[(4-methylthiazol-2-yl)thio]methyl]-N-(3-propionamidophenyl)coumarilamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

InChI

InChI=1S/C23H21N3O3S2/c1-3-20(27)25-15-7-6-8-16(11-15)26-22(28)21-18(13-31-23-24-14(2)12-30-23)17-9-4-5-10-19(17)29-21/h4-12H,3,13H2,1-2H3,(H,25,27)(H,26,28)