N-[2-methoxy-4-(naphthalen-1-ylcarbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[2-methoxy-4-(naphthalen-1-ylcarbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[2-methoxy-4-(naphthalene-1-carbonylcarbamothioylamino)phenyl]benzofuran-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[1-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[2-methoxy-4-(naphthalene-1-carbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[2-methoxy-4-(1-naphthoylthiocarbamoylamino)phenyl]coumarilamide Formula: C28H21N3O4S MolecularWeight: 495.54904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C28H21N3O4S/c1-34-24-16-19(13-14-22(24)30-27(33)25-15-18-8-3-5-12-23(18)35-25)29-28(36)31-26(32)21-11-6-9-17-7-2-4-10-20(17)21/h2-16H,1H3,(H,30,33)(H2,29,31,32,36)