N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C19H13N3OS3 MolecularWeight: 395.52102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C4=CC=CS4

InChI

InChI=1S/C19H13N3OS3/c23-17(16-10-5-11-25-16)22-19(24)21-13-7-2-1-6-12(13)18-20-14-8-3-4-9-15(14)26-18/h1-11H,(H2,21,22,23,24)