N-[3-[(2S)-2-(methylamino)propyl]phenyl]-3-sulfanyl-propanamide

Systemtic Name: N-[3-[(2S)-2-(methylamino)propyl]phenyl]-3-sulfanyl-propanamide Openeye Name: N-[3-[(2S)-2-(methylamino)propyl]phenyl]-3-sulfanyl-propanamide CAS Name: 3-mercapto-N-[3-[(2S)-2-(methylamino)propyl]phenyl]propanamide IUPAC Name: N-[3-[(2S)-2-(methylamino)propyl]phenyl]-3-sulfanylpropanamide Traditional Name: 3-mercapto-N-[3-[(2S)-2-(methylamino)propyl]phenyl]propionamide Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)NC(=O)CCS)NC

Isomeric SMILES

C[C@@H](CC1=CC(=CC=C1)NC(=O)CCS)NC

InChI

InChI=1S/C13H20N2OS/c1-10(14-2)8-11-4-3-5-12(9-11)15-13(16)6-7-17/h3-5,9-10,14,17H,6-8H2,1-2H3,(H,15,16)/t10-/m0/s1