2-azanyl-3-sulfanyl-propanoate; bis(azanyl)methylidene-decyl-azanium

Systemtic Name: 2-azanyl-3-sulfanyl-propanoate; bis(azanyl)methylidene-decyl-azanium Openeye Name: 2-amino-3-sulfanyl-propanoate; decyl(diaminomethylene)ammonium CAS Name: 2-amino-3-mercaptopropanoate; decyl(diaminomethylidene)ammonium IUPAC Name: 2-amino-3-sulfanylpropanoate; decyl(diaminomethylidene)azanium Traditional Name: 2-amino-3-mercapto-propionate; decyl(diaminomethylene)ammonium Formula: C14H32N4O2S MolecularWeight: 320.49448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[NH+]=C(N)N.C(C(C(=O)[O-])N)S

Isomeric SMILES

CCCCCCCCCC[NH+]=C(N)N.C(C(C(=O)[O-])N)S

InChI

InChI=1S/C11H25N3.C3H7NO2S/c1-2-3-4-5-6-7-8-9-10-14-11(12)13;4-2(1-7)3(5)6/h2-10H2,1H3,(H4,12,13,14);2,7H,1,4H2,(H,5,6)