3-chloranyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(E)-1-(4-morpholinophenyl)ethylideneamino]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(E)-1-[4-(4-morpholinyl)phenyl]ethylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(E)-1-(4-morpholin-4-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(E)-1-(4-morpholinophenyl)ethylideneamino]benzothiophene-2-carboxamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C2=CC=CC=C2S1)Cl)/C3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H20ClN3O2S/c1-14(15-6-8-16(9-7-15)25-10-12-27-13-11-25)23-24-21(26)20-19(22)17-4-2-3-5-18(17)28-20/h2-9H,10-13H2,1H3,(H,24,26)/b23-14+