1-[2-[[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[[4-(2,4-dimethoxyphenyl)thiazol-2-yl]amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[4-(2,4-dimethoxyphenyl)-2-thiazolyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[[4-(2,4-dimethoxyphenyl)thiazol-2-yl]amino]-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C19H25N4O4S+ MolecularWeight: 405.4912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCC(CC3)C(=O)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C[NH+]3CCC(CC3)C(=O)N)OC

InChI

InChI=1S/C19H24N4O4S/c1-26-13-3-4-14(16(9-13)27-2)15-11-28-19(21-15)22-17(24)10-23-7-5-12(6-8-23)18(20)25/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,20,25)(H,21,22,24)/p+1