N-[5-[[2,5-bis(chloranyl)phenyl]methyl]-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[5-[[2,5-bis(chloranyl)phenyl]methyl]-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[5-[(2,5-dichlorophenyl)methyl]thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[5-[(2,5-dichlorophenyl)methyl]-2-thiazolyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[5-(2,5-dichlorobenzyl)thiazol-2-yl]-2-morpholin-4-ium-4-yl-acetamide Formula: C16H18Cl2N3O2S+ MolecularWeight: 387.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3O2S/c17-12-1-2-14(18)11(7-12)8-13-9-19-16(24-13)20-15(22)10-21-3-5-23-6-4-21/h1-2,7,9H,3-6,8,10H2,(H,19,20,22)/p+1