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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(3-ethoxy-4-propoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(3-ethoxy-4-propoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(3-ethoxy-4-propoxy-benzylidene)amino]acetamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3S2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2)OCC

InChI

InChI=1S/C21H23N3O3S2/c1-3-11-27-17-10-9-15(12-18(17)26-4-2)13-22-24-20(25)14-28-21-23-16-7-5-6-8-19(16)29-21/h5-10,12-13H,3-4,11,14H2,1-2H3,(H,24,25)/b22-13+