3-benzamido-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methyl-benzamide

Systemtic Name: 3-benzamido-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methyl-benzamide Openeye Name: 3-benzamido-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methyl-benzamide CAS Name: 3-benzamido-N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-methylbenzamide IUPAC Name: 3-benzamido-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-methylbenzamide Traditional Name: 3-benzamido-N-[2-[(2-cyanobenzyl)thio]ethyl]-4-methyl-benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H23N3O2S/c1-18-11-12-20(15-23(18)28-25(30)19-7-3-2-4-8-19)24(29)27-13-14-31-17-22-10-6-5-9-21(22)16-26/h2-12,15H,13-14,17H2,1H3,(H,27,29)(H,28,30)