3-[cyclopropylcarbonyl-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[cyclopropylcarbonyl-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]propyl-diethyl-azanium Openeye Name: 3-[cyclopropanecarbonyl-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]amino]propyl-diethyl-ammonium CAS Name: 3-[[cyclopropyl(oxo)methyl]-[4-(2,5-dimethoxyphenyl)-2-thiazolyl]amino]propyl-diethylammonium IUPAC Name: 3-[cyclopropanecarbonyl-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]propyl-diethylazanium Traditional Name: 3-[cyclopropanecarbonyl-[4-(2,5-dimethoxyphenyl)thiazol-2-yl]amino]propyl-diethyl-ammonium Formula: C22H32N3O3S+ MolecularWeight: 418.57278

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)C3CC3

Isomeric SMILES

CC[NH+](CC)CCCN(C1=NC(=CS1)C2=C(C=CC(=C2)OC)OC)C(=O)C3CC3

InChI

InChI=1S/C22H31N3O3S/c1-5-24(6-2)12-7-13-25(21(26)16-8-9-16)22-23-19(15-29-22)18-14-17(27-3)10-11-20(18)28-4/h10-11,14-16H,5-9,12-13H2,1-4H3/p+1