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

Systemtic Name: 3-chloranyl-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[3-(hydroxymethyl)anilino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(3-methylolphenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H13ClN2O2S2 MolecularWeight: 376.88032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=CC(=C3)CO)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=CC(=C3)CO)Cl

InChI

InChI=1S/C17H13ClN2O2S2/c18-14-12-6-1-2-7-13(12)24-15(14)16(22)20-17(23)19-11-5-3-4-10(8-11)9-21/h1-8,21H,9H2,(H2,19,20,22,23)