N-(cyclopropylcarbamoyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(cyclopropylcarbamoyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(cyclopropylcarbamoyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(cyclopropylamino)-oxomethyl]-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(cyclopropylcarbamoyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(cyclopropylcarbamoyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C14H21N4O4S2+ MolecularWeight: 373.47094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CC1NC(=O)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C14H20N4O4S2/c19-12(16-14(20)15-11-3-4-11)10-17-5-7-18(8-6-17)24(21,22)13-2-1-9-23-13/h1-2,9,11H,3-8,10H2,(H2,15,16,19,20)/p+1