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

Systemtic Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[2-[2-[(2-cyanophenyl)methylthio]ethylamino]-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[2-[2-[(2-cyanobenzyl)thio]ethylamino]-2-keto-ethyl]-3-methyl-benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S/c1-15-5-4-8-16(11-15)20(25)23-13-19(24)22-9-10-26-14-18-7-3-2-6-17(18)12-21/h2-8,11H,9-10,13-14H2,1H3,(H,22,24)(H,23,25)