N-[(E)-(3-ethoxy-4-propoxy-phenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[(E)-(3-ethoxy-4-propoxy-phenyl)methylideneamino]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-[(E)-(3-ethoxy-4-propoxy-phenyl)methyleneamino]propanamide CAS Name: N-[(E)-(3-ethoxy-4-propoxyphenyl)methylideneamino]-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-[(E)-(3-ethoxy-4-propoxyphenyl)methylideneamino]propanamide Traditional Name: 2-(benzylthio)-N-[(E)-(3-ethoxy-4-propoxy-benzylidene)amino]propionamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=NNC(=O)C(C)SCC2=CC=CC=C2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=N/NC(=O)C(C)SCC2=CC=CC=C2)OCC

InChI

InChI=1S/C22H28N2O3S/c1-4-13-27-20-12-11-19(14-21(20)26-5-2)15-23-24-22(25)17(3)28-16-18-9-7-6-8-10-18/h6-12,14-15,17H,4-5,13,16H2,1-3H3,(H,24,25)/b23-15+