N-(2-azanyl-5-phenyl-phenyl)-6-[1-fluoranyl-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-azanyl-5-phenyl-phenyl)-6-[1-fluoranyl-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-amino-5-phenyl-phenyl)-6-[2-(benzylamino)-1-fluoro-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: N-(2-amino-5-phenylphenyl)-6-[1-fluoro-2-oxo-2-[(phenylmethyl)amino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-amino-5-phenylphenyl)-6-[2-(benzylamino)-1-fluoro-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-amino-5-phenyl-phenyl)-6-[2-(benzylamino)-1-fluoro-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C30H24FN3O2S MolecularWeight: 509.593863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=C(C=CC(=C4)C5=CC=CC=C5)N)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CC3=C(C=C2)C=C(S3)C(=O)NC4=C(C=CC(=C4)C5=CC=CC=C5)N)F

InChI

InChI=1S/C30H24FN3O2S/c31-28(30(36)33-18-19-7-3-1-4-8-19)23-12-11-22-16-27(37-26(22)17-23)29(35)34-25-15-21(13-14-24(25)32)20-9-5-2-6-10-20/h1-17,28H,18,32H2,(H,33,36)(H,34,35)