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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-pentoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-pentoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(3-ethoxy-4-pentoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-pentoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(4-amoxy-3-ethoxy-benzylidene)amino]-2-(1,3-benzothiazol-2-ylthio)acetamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C23H27N3O3S2/c1-3-5-8-13-29-19-12-11-17(14-20(19)28-4-2)15-24-26-22(27)16-30-23-25-18-9-6-7-10-21(18)31-23/h6-7,9-12,14-15H,3-5,8,13,16H2,1-2H3,(H,26,27)/b24-15+