N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methyl-benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-methylbenzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-methylbenzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-methyl-benzamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C18H18N2OS/c1-14-5-4-8-15(11-14)18(21)20-9-10-22-13-17-7-3-2-6-16(17)12-19/h2-8,11H,9-10,13H2,1H3,(H,20,21)