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

Systemtic Name: 2-[cyclohexylcarbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[cyclohexanecarbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[[cyclohexyl(oxo)methyl]-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[cyclohexanecarbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethylazanium Traditional Name: 2-[cyclohexanecarbonyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]ethyl-diethyl-ammonium Formula: C21H32N3O2S+ MolecularWeight: 390.56268

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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)C3CCCCC3

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(S1)C=C(C=C2)OC)C(=O)C3CCCCC3

InChI

InChI=1S/C21H31N3O2S/c1-4-23(5-2)13-14-24(20(25)16-9-7-6-8-10-16)21-22-18-12-11-17(26-3)15-19(18)27-21/h11-12,15-16H,4-10,13-14H2,1-3H3/p+1