3-[(6-chloranyl-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(6-chloranyl-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(6-chloro-1,3-benzothiazol-2-yl)-[5-isoxazolyl(oxo)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(1,2-oxazole-5-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(6-chloro-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium Formula: C16H18ClN4O2S+ MolecularWeight: 365.85772

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=NO3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=NO3

InChI

InChI=1S/C16H17ClN4O2S/c1-20(2)8-3-9-21(15(22)13-6-7-18-23-13)16-19-12-5-4-11(17)10-14(12)24-16/h4-7,10H,3,8-9H2,1-2H3/p+1