N-(2-dimethylaminoethyl)-2-phenylsulfanyl-propanamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-phenylsulfanyl-propanamide Openeye Name: N-(2-dimethylaminoethyl)-2-phenylsulfanyl-propanamide CAS Name: N-(2-dimethylaminoethyl)-2-(phenylthio)propanamide IUPAC Name: N-(2-dimethylaminoethyl)-2-phenylsulfanylpropanamide Traditional Name: N-(2-dimethylaminoethyl)-2-(phenylthio)propionamide Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCN(C)C)SC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NCCN(C)C)SC1=CC=CC=C1

InChI

InChI=1S/C13H20N2OS/c1-11(13(16)14-9-10-15(2)3)17-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3,(H,14,16)