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

Systemtic Name: 3-butoxy-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)O

InChI

InChI=1S/C19H19N3O3S2/c1-2-3-9-25-14-6-4-5-12(10-14)17(24)21-18(26)22-19-20-15-8-7-13(23)11-16(15)27-19/h4-8,10-11,23H,2-3,9H2,1H3,(H2,20,21,22,24,26)