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

Systemtic Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2-methylpyrazol-3-yl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-[(2-methyl-3-pyrazolyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4,7-dimethoxy-1,3-benzothiazol-2-yl)-(2-methylpyrazole-3-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C18H24N5O3S+ MolecularWeight: 390.47986

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)N(CC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)OC)OC

Isomeric SMILES

CN1C(=CC=N1)C(=O)N(CC[NH+](C)C)C2=NC3=C(C=CC(=C3S2)OC)OC

InChI

InChI=1S/C18H23N5O3S/c1-21(2)10-11-23(17(24)12-8-9-19-22(12)3)18-20-15-13(25-4)6-7-14(26-5)16(15)27-18/h6-9H,10-11H2,1-5H3/p+1