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

Systemtic Name: 3-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(1,5-dimethylpyrazol-3-yl)carbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(1,5-dimethylpyrazole-3-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(1,5-dimethylpyrazole-3-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(1,5-dimethylpyrazole-3-carbonyl)amino]propyl-dimethyl-ammonium Formula: C19H25ClN5O2S+ MolecularWeight: 422.9521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N(CCC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)Cl)OC

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N(CCC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)Cl)OC

InChI

InChI=1S/C19H24ClN5O2S/c1-12-11-14(22-24(12)4)18(26)25(10-6-9-23(2)3)19-21-16-15(27-5)8-7-13(20)17(16)28-19/h7-8,11H,6,9-10H2,1-5H3/p+1