2-[(4-dimethylaminophenyl)carbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(4-dimethylaminophenyl)carbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[[4-(dimethylamino)benzoyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[(4-dimethylaminophenyl)-oxomethyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[[4-(dimethylamino)benzoyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[[4-(dimethylamino)benzoyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium Formula: C23H31N4O2S+ MolecularWeight: 427.58284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O2S/c1-6-26(7-2)14-15-27(22(28)17-8-10-18(11-9-17)25(3)4)23-24-20-13-12-19(29-5)16-21(20)30-23/h8-13,16H,6-7,14-15H2,1-5H3/p+1