N-cyclopropyl-2-[4-[3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[1-oxo-3-[(2,4,6-trimethylphenyl)sulfonylamino]propyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[3-(mesitylsulfonylamino)propanoyl]piperazin-1-ium-1-yl]acetamide Formula: C21H33N4O4S+ MolecularWeight: 437.57612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)N2CC[NH+](CC2)CC(=O)NC3CC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)N2CC[NH+](CC2)CC(=O)NC3CC3)C

InChI

InChI=1S/C21H32N4O4S/c1-15-12-16(2)21(17(3)13-15)30(28,29)22-7-6-20(27)25-10-8-24(9-11-25)14-19(26)23-18-4-5-18/h12-13,18,22H,4-11,14H2,1-3H3,(H,23,26)/p+1