3-chloranyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[2-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[2-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[2-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C21H19ClN2O3S2 MolecularWeight: 446.97016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=CC=C2NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CC(OC1)COC2=CC=CC=C2NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H19ClN2O3S2/c22-18-14-7-1-4-10-17(14)29-19(18)20(25)24-21(28)23-15-8-2-3-9-16(15)27-12-13-6-5-11-26-13/h1-4,7-10,13H,5-6,11-12H2,(H2,23,24,25,28)