3,5-diethoxy-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 3,5-diethoxy-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3,5-diethoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 3,5-diethoxy-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-diethoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 3,5-diethoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O)OCC

InChI

InChI=1S/C19H19N3O4S2/c1-3-25-13-7-11(8-14(10-13)26-4-2)17(24)21-18(27)22-19-20-15-6-5-12(23)9-16(15)28-19/h5-10,23H,3-4H2,1-2H3,(H2,20,21,22,24,27)