2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2,5-dimethylpyrazol-3-yl)carbonyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2,5-dimethylpyrazol-3-yl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2,5-dimethylpyrazole-3-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-[(2,5-dimethyl-3-pyrazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2,5-dimethylpyrazole-3-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2,5-dimethylpyrazole-3-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C19H26N5O3S+ MolecularWeight: 404.50644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)N(CC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)OC)OC)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)N(CC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)OC)OC)C

InChI

InChI=1S/C19H25N5O3S/c1-12-11-13(23(4)21-12)18(25)24(10-9-22(2)3)19-20-16-14(26-5)7-8-15(27-6)17(16)28-19/h7-8,11H,9-10H2,1-6H3/p+1