2-[(6-chloranyl-1,3-benzothiazol-2-yl)-(3,5-dimethoxyphenyl)carbonyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(6-chloranyl-1,3-benzothiazol-2-yl)-(3,5-dimethoxyphenyl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(3,5-dimethoxybenzoyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-[(3,5-dimethoxyphenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(3,5-dimethoxybenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(3,5-dimethoxybenzoyl)amino]ethyl-dimethyl-ammonium Formula: C20H23ClN3O3S+ MolecularWeight: 420.93292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3S/c1-23(2)7-8-24(20-22-17-6-5-14(21)11-18(17)28-20)19(25)13-9-15(26-3)12-16(10-13)27-4/h5-6,9-12H,7-8H2,1-4H3/p+1