3-chloranyl-N-[2-oxidanylidene-2-[[4-(phenoxymethyl)phenyl]methylamino]ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-oxidanylidene-2-[[4-(phenoxymethyl)phenyl]methylamino]ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-oxo-2-[[4-(phenoxymethyl)phenyl]methylamino]ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-oxo-2-[[4-(phenoxymethyl)phenyl]methylamino]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-oxo-2-[[4-(phenoxymethyl)phenyl]methylamino]ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-keto-2-[[4-(phenoxymethyl)benzyl]amino]ethyl]benzothiophene-2-carboxamide Formula: C25H21ClN2O3S MolecularWeight: 464.96384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=C(C=C2)CNC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=C(C=C2)CNC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C25H21ClN2O3S/c26-23-20-8-4-5-9-21(20)32-24(23)25(30)28-15-22(29)27-14-17-10-12-18(13-11-17)16-31-19-6-2-1-3-7-19/h1-13H,14-16H2,(H,27,29)(H,28,30)