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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-phenethyloxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-phenethyloxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(3-ethoxy-4-phenethyloxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-phenethyloxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(3-ethoxy-4-phenethyloxy-benzylidene)amino]acetamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2)OCCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2)OCCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3S2/c1-2-31-23-16-20(12-13-22(23)32-15-14-19-8-4-3-5-9-19)17-27-29-25(30)18-33-26-28-21-10-6-7-11-24(21)34-26/h3-13,16-17H,2,14-15,18H2,1H3,(H,29,30)/b27-17+