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

Systemtic Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-phenylquinolin-4-yl)carbonyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-phenylquinoline-4-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)-[oxo-(2-phenyl-4-quinolinyl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-phenylquinoline-4-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(5-methoxy-1,3-benzothiazol-2-yl)-(2-phenylquinoline-4-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C28H27N4O2S+ MolecularWeight: 483.60458

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C1=NC2=C(S1)C=CC(=C2)OC)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C[NH+](C)CCN(C1=NC2=C(S1)C=CC(=C2)OC)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H26N4O2S/c1-31(2)15-16-32(28-30-25-17-20(34-3)13-14-26(25)35-28)27(33)22-18-24(19-9-5-4-6-10-19)29-23-12-8-7-11-21(22)23/h4-14,17-18H,15-16H2,1-3H3/p+1