3-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(1,2-oxazol-5-ylcarbonyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-[5-isoxazolyl(oxo)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(1,2-oxazole-5-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(isoxazole-5-carbonyl)amino]propyl-dimethyl-ammonium Formula: C17H20ClN4O3S+ MolecularWeight: 395.8837

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=C(C=CC(=C2S1)Cl)OC)C(=O)C3=CC=NO3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(C=CC(=C2S1)Cl)OC)C(=O)C3=CC=NO3

InChI

InChI=1S/C17H19ClN4O3S/c1-21(2)9-4-10-22(16(23)13-7-8-19-25-13)17-20-14-12(24-3)6-5-11(18)15(14)26-17/h5-8H,4,9-10H2,1-3H3/p+1