3-[(3-azanyl-3-sulfanylidene-propanoyl)amino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(3-azanyl-3-sulfanylidene-propanoyl)amino]propyl-methyl-(phenylmethyl)azanium Openeye Name: 3-[(3-amino-3-thioxo-propanoyl)amino]propyl-benzyl-methyl-ammonium CAS Name: 3-[(3-amino-1-oxo-3-sulfanylidenepropyl)amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: 3-[(3-amino-3-sulfanylidenepropanoyl)amino]propyl-benzyl-methylazanium Traditional Name: 3-[(3-amino-3-thioxo-propanoyl)amino]propyl-benzyl-methyl-ammonium Formula: C14H22N3OS+ MolecularWeight: 280.40898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)CC(=S)N)CC1=CC=CC=C1

Isomeric SMILES

C[NH+](CCCNC(=O)CC(=S)N)CC1=CC=CC=C1

InChI

InChI=1S/C14H21N3OS/c1-17(11-12-6-3-2-4-7-12)9-5-8-16-14(18)10-13(15)19/h2-4,6-7H,5,8-11H2,1H3,(H2,15,19)(H,16,18)/p+1