2-[(5-chloranylthiophen-2-yl)carbonyl-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)carbonyl-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-chlorothiophene-2-carbonyl)-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(5-chloro-2-thiophenyl)-oxomethyl]-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-chlorothiophene-2-carbonyl)-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(5-chlorothiophene-2-carbonyl)-(4-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-dimethyl-ammonium Formula: C17H19ClN3O2S2+ MolecularWeight: 396.93466

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(C=CC=C2S1)OC)C(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O2S2/c1-20(2)9-10-21(16(22)13-7-8-14(18)24-13)17-19-15-11(23-3)5-4-6-12(15)25-17/h4-8H,9-10H2,1-3H3/p+1