4-bromanyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]benzamide Openeye Name: 4-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]benzamide CAS Name: 4-bromo-N-[2-[(2-cyanophenyl)methylthio]ethyl]benzamide IUPAC Name: 4-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]benzamide Traditional Name: 4-bromo-N-[2-[(2-cyanobenzyl)thio]ethyl]benzamide Formula: C17H15BrN2OS MolecularWeight: 375.2828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=C(C=C2)Br)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C17H15BrN2OS/c18-16-7-5-13(6-8-16)17(21)20-9-10-22-12-15-4-2-1-3-14(15)11-19/h1-8H,9-10,12H2,(H,20,21)