5-(1,3-benzothiazol-2-yl)pentylazanium

Systemtic Name: 5-(1,3-benzothiazol-2-yl)pentylazanium Openeye Name: 5-(1,3-benzothiazol-2-yl)pentylammonium CAS Name: 5-(1,3-benzothiazol-2-yl)pentylammonium IUPAC Name: 5-(1,3-benzothiazol-2-yl)pentylazanium Traditional Name: 5-(1,3-benzothiazol-2-yl)pentylammonium Formula: C12H17N2S+ MolecularWeight: 221.34178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCCC[NH3+]

InChI

InChI=1S/C12H16N2S/c13-9-5-1-2-8-12-14-10-6-3-4-7-11(10)15-12/h3-4,6-7H,1-2,5,8-9,13H2/p+1