2-azanyl-6-[ethanimidoyl(phenylsulfanyl)amino]hexanoic acid

Systemtic Name: 2-azanyl-6-[ethanimidoyl(phenylsulfanyl)amino]hexanoic acid Openeye Name: 2-amino-6-[ethanimidoyl(phenylsulfanyl)amino]hexanoic acid CAS Name: 2-amino-6-[1-iminoethyl-(phenylthio)amino]hexanoic acid IUPAC Name: 2-amino-6-[ethanimidoyl(phenylsulfanyl)amino]hexanoic acid Traditional Name: 6-[acetimidoyl-(phenylthio)amino]-2-amino-hexanoic acid Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N(CCCCC(C(=O)O)N)SC1=CC=CC=C1

Isomeric SMILES

CC(=N)N(CCCCC(C(=O)O)N)SC1=CC=CC=C1

InChI

InChI=1S/C14H21N3O2S/c1-11(15)17(20-12-7-3-2-4-8-12)10-6-5-9-13(16)14(18)19/h2-4,7-8,13,15H,5-6,9-10,16H2,1H3,(H,18,19)