4,5-bis(bromanyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 4,5-dibromo-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide CAS Name: 4,5-dibromo-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 4,5-dibromo-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]thiophene-2-carboxamide Traditional Name: 4,5-dibromo-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]thiophene-2-carboxamide Formula: C17H19Br2N2O2S+ MolecularWeight: 475.21796

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C17H18Br2N2O2S/c18-14-9-15(24-16(14)19)17(22)20-10-12-3-1-2-4-13(12)11-21-5-7-23-8-6-21/h1-4,9H,5-8,10-11H2,(H,20,22)/p+1