2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-hexoxyphenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-hexoxyphenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-hexoxyphenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(4-hexoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-hexoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(4-hexoxybenzylidene)amino]acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C22H25N3O2S2/c1-2-3-4-7-14-27-18-12-10-17(11-13-18)15-23-25-21(26)16-28-22-24-19-8-5-6-9-20(19)29-22/h5-6,8-13,15H,2-4,7,14,16H2,1H3,(H,25,26)/b23-15+