3-azanyl-3-[4-[(2R,4S)-4-sulfanylpyrrolidin-2-yl]phenyl]propanamide

Systemtic Name: 3-azanyl-3-[4-[(2R,4S)-4-sulfanylpyrrolidin-2-yl]phenyl]propanamide Openeye Name: 3-amino-3-[4-[(2R,4S)-4-sulfanylpyrrolidin-2-yl]phenyl]propanamide CAS Name: 3-amino-3-[4-[(2R,4S)-4-mercapto-2-pyrrolidinyl]phenyl]propanamide IUPAC Name: 3-amino-3-[4-[(2R,4S)-4-sulfanylpyrrolidin-2-yl]phenyl]propanamide Traditional Name: 3-amino-3-[4-[(2R,4S)-4-mercaptopyrrolidin-2-yl]phenyl]propionamide Formula: C13H19N3OS MolecularWeight: 265.37446

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C2=CC=C(C=C2)C(CC(=O)N)N)S

Isomeric SMILES

C1[C@@H](CN[C@H]1C2=CC=C(C=C2)C(CC(=O)N)N)S

InChI

InChI=1S/C13H19N3OS/c14-11(6-13(15)17)8-1-3-9(4-2-8)12-5-10(18)7-16-12/h1-4,10-12,16,18H,5-7,14H2,(H2,15,17)/t10-,11?,12+/m0/s1