N-(2-aminophenyl)-6-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[2-oxo-2-(5-quinolylamino)ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[2-oxo-2-(5-quinolinylamino)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[2-oxo-2-(quinolin-5-ylamino)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[2-keto-2-(5-quinolylamino)ethyl]benzothiophene-2-carboxamide Formula: C26H20N4O2S MolecularWeight: 452.5276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC3=C(S2)C=C(C=C3)CC(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC3=C(S2)C=C(C=C3)CC(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C26H20N4O2S/c27-19-6-1-2-7-22(19)30-26(32)24-15-17-11-10-16(13-23(17)33-24)14-25(31)29-21-9-3-8-20-18(21)5-4-12-28-20/h1-13,15H,14,27H2,(H,29,31)(H,30,32)