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

Systemtic Name: 3-[(3,5-dimethoxyphenyl)carbonyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(3,5-dimethoxybenzoyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(3,5-dimethoxyphenyl)-oxomethyl]-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[(3,5-dimethoxybenzoyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(3,5-dimethoxybenzoyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C23H29N3O3S/c1-15-10-20-21(11-16(15)2)30-23(24-20)26(9-7-8-25(3)4)22(27)17-12-18(28-5)14-19(13-17)29-6/h10-14H,7-9H2,1-6H3/p+1