2-[[(3S,4R)-1-(phenylmethyl)-4-(2-sulfanylethylamino)pyrrolidin-3-yl]amino]ethanethiol

Systemtic Name: 2-[[(3S,4R)-1-(phenylmethyl)-4-(2-sulfanylethylamino)pyrrolidin-3-yl]amino]ethanethiol Openeye Name: 2-[[(3S,4R)-1-benzyl-4-(2-sulfanylethylamino)pyrrolidin-3-yl]amino]ethanethiol CAS Name: 2-[[(3S,4R)-4-(2-mercaptoethylamino)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethanethiol IUPAC Name: 2-[[(3S,4R)-1-benzyl-4-(2-sulfanylethylamino)pyrrolidin-3-yl]amino]ethanethiol Traditional Name: 2-[[(3S,4R)-1-benzyl-4-(2-mercaptoethylamino)pyrrolidin-3-yl]amino]ethanethiol Formula: C15H25N3S2 MolecularWeight: 311.5091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1CC2=CC=CC=C2)NCCS)NCCS

Isomeric SMILES

C1[C@H]([C@H](CN1CC2=CC=CC=C2)NCCS)NCCS

InChI

InChI=1S/C15H25N3S2/c19-8-6-16-14-11-18(12-15(14)17-7-9-20)10-13-4-2-1-3-5-13/h1-5,14-17,19-20H,6-12H2/t14-,15+