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

Systemtic Name: 3-bromanyl-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[2-[(2-cyanobenzyl)thio]ethyl]-4-methoxy-benzamide Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-23-17-7-6-13(10-16(17)19)18(22)21-8-9-24-12-15-5-3-2-4-14(15)11-20/h2-7,10H,8-9,12H2,1H3,(H,21,22)