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

Systemtic Name: 6-bromanyl-3-chloranyl-N-[(E)-1-(4-propan-2-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 6-bromo-3-chloro-N-[(E)-1-(4-isopropylphenyl)ethylideneamino]benzothiophene-2-carboxamide CAS Name: 6-bromo-3-chloro-N-[(E)-1-(4-propan-2-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 6-bromo-3-chloro-N-[(E)-1-(4-propan-2-ylphenyl)ethylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 6-bromo-3-chloro-N-[(E)-1-p-cumenylethylideneamino]benzothiophene-2-carboxamide Formula: C20H18BrClN2OS MolecularWeight: 449.79172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=NNC(=O)C2=C(C3=C(S2)C=C(C=C3)Br)Cl)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C(=N/NC(=O)C2=C(C3=C(S2)C=C(C=C3)Br)Cl)/C

InChI

InChI=1S/C20H18BrClN2OS/c1-11(2)13-4-6-14(7-5-13)12(3)23-24-20(25)19-18(22)16-9-8-15(21)10-17(16)26-19/h4-11H,1-3H3,(H,24,25)/b23-12+