3-cyano-N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]benzamide

Systemtic Name: 3-cyano-N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]benzamide Openeye Name: 3-cyano-N-[4-[2-oxo-2-(2-thienylmethylamino)ethyl]phenyl]benzamide CAS Name: 3-cyano-N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]benzamide IUPAC Name: 3-cyano-N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]benzamide Traditional Name: 3-cyano-N-[4-[2-keto-2-(2-thenylamino)ethyl]phenyl]benzamide Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)CC(=O)NCC3=CC=CS3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)CC(=O)NCC3=CC=CS3)C#N

InChI

InChI=1S/C21H17N3O2S/c22-13-16-3-1-4-17(11-16)21(26)24-18-8-6-15(7-9-18)12-20(25)23-14-19-5-2-10-27-19/h1-11H,12,14H2,(H,23,25)(H,24,26)