diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-thiophen-2-ylcarbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-[oxo(thiophen-2-yl)methyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(thiophene-2-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-(2-thenoyl)amino]ethyl]ammonium Formula: C20H26N3O2S2+ MolecularWeight: 404.56934

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=CS3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(C=CC(=C2S1)C)OC)C(=O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O2S2/c1-5-22(6-2)11-12-23(19(24)16-8-7-13-26-16)20-21-17-15(25-4)10-9-14(3)18(17)27-20/h7-10,13H,5-6,11-12H2,1-4H3/p+1