2-azanyl-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]butanamide

Systemtic Name: 2-azanyl-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]butanamide Openeye Name: 2-amino-N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]butanamide CAS Name: 2-amino-N-[2-[(2-amino-2-oxoethyl)thio]phenyl]butanamide IUPAC Name: 2-amino-N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]butanamide Traditional Name: 2-amino-N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]butyramide Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O2S/c1-2-8(13)12(17)15-9-5-3-4-6-10(9)18-7-11(14)16/h3-6,8H,2,7,13H2,1H3,(H2,14,16)(H,15,17)