2-azanyl-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-methyl-pentanamide

Systemtic Name: 2-azanyl-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-methyl-pentanamide Openeye Name: 2-amino-N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-3-methyl-pentanamide CAS Name: 2-amino-N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-3-methylpentanamide IUPAC Name: 2-amino-N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-methylpentanamide Traditional Name: 2-amino-N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-3-methyl-valeramide Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=CC=C1SCC(=O)N)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC=CC=C1SCC(=O)N)N

InChI

InChI=1S/C14H21N3O2S/c1-3-9(2)13(16)14(19)17-10-6-4-5-7-11(10)20-8-12(15)18/h4-7,9,13H,3,8,16H2,1-2H3,(H2,15,18)(H,17,19)