(2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]-2-methylsulfanylimino-ethanamide

Systemtic Name: (2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]-2-methylsulfanylimino-ethanamide Openeye Name: (2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-prop-2-ynoxy-phenyl)ethyl]-2-methylsulfanylimino-acetamide CAS Name: (2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]-2-(methylthio)iminoacetamide IUPAC Name: (2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-prop-2-ynoxyphenyl)ethyl]-2-methylsulfanyliminoacetamide Traditional Name: (2E)-2-(4-bromophenyl)-N-[2-(3-methoxy-4-propargyloxy-phenyl)ethyl]-2-(methylthio)imino-acetamide Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCNC(=O)C(=NSC)C2=CC=C(C=C2)Br)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)CCNC(=O)/C(=N/SC)/C2=CC=C(C=C2)Br)OCC#C

InChI

InChI=1S/C21H21BrN2O3S/c1-4-13-27-18-10-5-15(14-19(18)26-2)11-12-23-21(25)20(24-28-3)16-6-8-17(22)9-7-16/h1,5-10,14H,11-13H2,2-3H3,(H,23,25)/b24-20+