[2-(3-azaniumylpropyl)-1,3-benzothiazol-6-yl]methyl-diethyl-azanium

Systemtic Name: [2-(3-azaniumylpropyl)-1,3-benzothiazol-6-yl]methyl-diethyl-azanium Openeye Name: [2-(3-azaniumylpropyl)-1,3-benzothiazol-6-yl]methyl-diethyl-ammonium CAS Name: [2-(3-ammoniopropyl)-1,3-benzothiazol-6-yl]methyl-diethylammonium IUPAC Name: [2-(3-azaniumylpropyl)-1,3-benzothiazol-6-yl]methyl-diethylazanium Traditional Name: [2-(3-ammoniopropyl)-1,3-benzothiazol-6-yl]methyl-diethyl-ammonium Formula: C15H25N3S+2 MolecularWeight: 279.4441

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC2=C(C=C1)N=C(S2)CCC[NH3+]

Isomeric SMILES

CC[NH+](CC)CC1=CC2=C(C=C1)N=C(S2)CCC[NH3+]

InChI

InChI=1S/C15H23N3S/c1-3-18(4-2)11-12-7-8-13-14(10-12)19-15(17-13)6-5-9-16/h7-8,10H,3-6,9,11,16H2,1-2H3/p+2