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

Systemtic Name: 2-[1,3-benzothiazol-2-yl-(4-dimethylaminophenyl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[1,3-benzothiazol-2-yl-[4-(dimethylamino)benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[1,3-benzothiazol-2-yl-[(4-dimethylaminophenyl)-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[1,3-benzothiazol-2-yl-[4-(dimethylamino)benzoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[1,3-benzothiazol-2-yl-[4-(dimethylamino)benzoyl]amino]ethyl-dimethyl-ammonium Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C20H24N4OS/c1-22(2)13-14-24(20-21-17-7-5-6-8-18(17)26-20)19(25)15-9-11-16(12-10-15)23(3)4/h5-12H,13-14H2,1-4H3/p+1