2-(4-bromophenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-propanamide CAS Name: 2-[(4-bromophenyl)thio]-N-(2-cyanoethyl)-N-phenylpropanamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-(2-cyanoethyl)-N-phenylpropanamide Traditional Name: 2-[(4-bromophenyl)thio]-N-(2-cyanoethyl)-N-phenyl-propionamide Formula: C18H17BrN2OS MolecularWeight: 389.30938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H17BrN2OS/c1-14(23-17-10-8-15(19)9-11-17)18(22)21(13-5-12-20)16-6-3-2-4-7-16/h2-4,6-11,14H,5,13H2,1H3