3-[(4-chloranyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-chloranyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-chloro-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]propyl-dimethyl-ammonium Formula: C17H19ClN3OS2+ MolecularWeight: 380.93526

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC2=C(S1)C=CC=C2Cl)C(=O)C3=CC=CS3

InChI

InChI=1S/C17H18ClN3OS2/c1-20(2)9-5-10-21(16(22)14-8-4-11-23-14)17-19-15-12(18)6-3-7-13(15)24-17/h3-4,6-8,11H,5,9-10H2,1-2H3/p+1