[4-(azepan-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]methylazanium

Systemtic Name: [4-(azepan-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]methylazanium Openeye Name: [4-(azepan-1-ium-1-ylmethyl)thiazol-2-yl]methylammonium CAS Name: [4-(1-azepan-1-iumylmethyl)-2-thiazolyl]methylammonium IUPAC Name: [4-(azepan-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]methylazanium Traditional Name: [4-(azepan-1-ium-1-ylmethyl)thiazol-2-yl]methylammonium Formula: C11H21N3S+2 MolecularWeight: 227.36954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC2=CSC(=N2)C[NH3+]

Isomeric SMILES

C1CCC[NH+](CC1)CC2=CSC(=N2)C[NH3+]

InChI

InChI=1S/C11H19N3S/c12-7-11-13-10(9-15-11)8-14-5-3-1-2-4-6-14/h9H,1-8,12H2/p+2