N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-pyridin-4-yl-propanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-pyridin-4-yl-propanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(4-pyridyl)propanamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-pyridin-4-ylpropanamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-pyridin-4-ylpropanamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(4-pyridyl)propionamide Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CCC2=CC=NC=C2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CCC2=CC=NC=C2)C#N

InChI

InChI=1S/C18H19N3OS/c19-13-16-3-1-2-4-17(16)14-23-12-11-21-18(22)6-5-15-7-9-20-10-8-15/h1-4,7-10H,5-6,11-12,14H2,(H,21,22)