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

Systemtic Name: 2-[(4-ethanoylphenyl)carbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(4-acetylbenzoyl)-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[(4-acetylphenyl)-oxomethyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[(4-acetylbenzoyl)-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[(4-acetylbenzoyl)-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium Formula: C23H28N3O3S+ MolecularWeight: 426.55172

Click to see the large picture

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)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S/c1-5-25(6-2)13-14-26(22(28)18-9-7-17(8-10-18)16(3)27)23-24-20-12-11-19(29-4)15-21(20)30-23/h7-12,15H,5-6,13-14H2,1-4H3/p+1