3-chloranyl-N-[[(2-hydroxyphenyl)carbonylamino]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[(2-hydroxyphenyl)carbonylamino]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[(2-hydroxybenzoyl)amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[(2-hydroxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[(2-hydroxybenzoyl)amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(salicyloylamino)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H12ClN3O3S2 MolecularWeight: 405.87848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3O)Cl

InChI

InChI=1S/C17H12ClN3O3S2/c18-13-10-6-2-4-8-12(10)26-14(13)16(24)19-17(25)21-20-15(23)9-5-1-3-7-11(9)22/h1-8,22H,(H,20,23)(H2,19,21,24,25)