2-azanyl-3-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-[benzyl(ethyl)amino]-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-[ethyl-(phenylmethyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-[benzyl(ethyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-[benzyl(ethyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C14H20N2O3S/c1-2-16(8-11-6-4-3-5-7-11)13(17)10-20-9-12(15)14(18)19/h3-7,12H,2,8-10,15H2,1H3,(H,18,19)