2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-ium-1-yl]-N-(phenylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-ium-1-yl]-N-(phenylcarbamoyl)ethanamide Openeye Name: 2-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide CAS Name: N-[anilino(oxo)methyl]-2-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide Traditional Name: 2-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-ium-1-yl]-N-(phenylcarbamoyl)acetamide Formula: C22H29N6O5S+ MolecularWeight: 489.56786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC(=O)NC2=CC=CC=C2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC(=O)NC2=CC=CC=C2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H28N6O5S/c29-21(25-22(30)24-18-4-2-1-3-5-18)17-26-8-10-27(11-9-26)20-7-6-19(16-23-20)34(31,32)28-12-14-33-15-13-28/h1-7,16H,8-15,17H2,(H2,24,25,29,30)/p+1