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

Systemtic Name: 3-[(5-chloranylthiophen-2-yl)carbonyl-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(5-chlorothiophene-2-carbonyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(5-chloro-2-thiophenyl)-oxomethyl]-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[(5-chlorothiophene-2-carbonyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(5-chlorothiophene-2-carbonyl)-(5,6-dimethyl-1,3-benzothiazol-2-yl)amino]propyl-dimethyl-ammonium Formula: C19H23ClN3OS2+ MolecularWeight: 408.98842

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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=C(S3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CCC[NH+](C)C)C(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C19H22ClN3OS2/c1-12-10-14-16(11-13(12)2)26-19(21-14)23(9-5-8-22(3)4)18(24)15-6-7-17(20)25-15/h6-7,10-11H,5,8-9H2,1-4H3/p+1