N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-butoxy-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-butoxy-benzamide Openeye Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-butoxy-benzamide CAS Name: N-[(1,3-benzothiazol-2-ylamino)-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)-4-butoxybenzamide Traditional Name: N-(1,3-benzothiazol-2-ylthiocarbamoyl)-4-butoxy-benzamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O2S2/c1-2-3-12-24-14-10-8-13(9-11-14)17(23)21-18(25)22-19-20-15-6-4-5-7-16(15)26-19/h4-11H,2-3,12H2,1H3,(H2,20,21,22,23,25)