2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(tetralin-6-carbonyl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)-[oxo(5,6,7,8-tetrahydronaphthalen-2-yl)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(5,6,7,8-tetrahydronaphthalene-2-carbonyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(tetralin-6-carbonyl)amino]ethyl-dimethyl-ammonium Formula: C24H30N3O2S+ MolecularWeight: 424.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CC[NH+](C)C)C(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CC[NH+](C)C)C(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C24H29N3O2S/c1-4-29-20-11-12-21-22(16-20)30-24(25-21)27(14-13-26(2)3)23(28)19-10-9-17-7-5-6-8-18(17)15-19/h9-12,15-16H,4-8,13-14H2,1-3H3/p+1