(2S)-2-azanyl-N-[(4-carbamimidoylphenyl)methyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[(4-carbamimidoylphenyl)methyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-[(4-carbamimidoylphenyl)methyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-[(4-carbamimidoylphenyl)methyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-[(4-carbamimidoylphenyl)methyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-N-(4-amidinobenzyl)-2-amino-4-(methylthio)butyramide Formula: C13H20N4OS MolecularWeight: 280.3891

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=C(C=C1)C(=N)N)N

Isomeric SMILES

CSCC[C@@H](C(=O)NCC1=CC=C(C=C1)C(=N)N)N

InChI

InChI=1S/C13H20N4OS/c1-19-7-6-11(14)13(18)17-8-9-2-4-10(5-3-9)12(15)16/h2-5,11H,6-8,14H2,1H3,(H3,15,16)(H,17,18)/t11-/m0/s1