2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-(3-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-(3-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]ethanamide Openeye Name: N-[(E)-(4-allyloxy-3-methoxy-phenyl)methyleneamino]-2-[(3-bromophenyl)methylsulfanyl]acetamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(4-allyloxy-3-methoxy-benzylidene)amino]-2-[(3-bromobenzyl)thio]acetamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CSCC2=CC(=CC=C2)Br)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)CSCC2=CC(=CC=C2)Br)OCC=C

InChI

InChI=1S/C20H21BrN2O3S/c1-3-9-26-18-8-7-15(11-19(18)25-2)12-22-23-20(24)14-27-13-16-5-4-6-17(21)10-16/h3-8,10-12H,1,9,13-14H2,2H3,(H,23,24)/b22-12+