2-[(6-chloranyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(6-chloranyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]ethyl-diethyl-azanium Openeye Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]ethyl-diethylammonium IUPAC Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl-diethylazanium Traditional Name: 2-[(6-chloro-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]ethyl-diethyl-ammonium Formula: C18H21ClN3OS2+ MolecularWeight: 394.96184

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=CS3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)Cl)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H20ClN3OS2/c1-3-21(4-2)9-10-22(17(23)15-6-5-11-24-15)18-20-14-8-7-13(19)12-16(14)25-18/h5-8,11-12H,3-4,9-10H2,1-2H3/p+1