3-(3-chloranyl-4-methyl-phenyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 3-(3-chloro-4-methyl-phenyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide CAS Name: 3-(3-chloro-4-methylphenyl)-N-[2-[(2-cyanophenyl)methylthio]ethyl]propanamide IUPAC Name: 3-(3-chloro-4-methylphenyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 3-(3-chloro-4-methyl-phenyl)-N-[2-[(2-cyanobenzyl)thio]ethyl]propionamide Formula: C20H21ClN2OS MolecularWeight: 372.91154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2OS/c1-15-6-7-16(12-19(15)21)8-9-20(24)23-10-11-25-14-18-5-3-2-4-17(18)13-22/h2-7,12H,8-11,14H2,1H3,(H,23,24)