3-cyclopropyl-3-[[ethyl-[methyl(piperidin-3-yl)carbamoyl]sulfonyl-carbamoyl]amino]propanoic acid

Systemtic Name: 3-cyclopropyl-3-[[ethyl-[methyl(piperidin-3-yl)carbamoyl]sulfonyl-carbamoyl]amino]propanoic acid Openeye Name: 3-cyclopropyl-3-[[ethyl-[methyl(3-piperidyl)carbamoyl]sulfonyl-carbamoyl]amino]propanoic acid CAS Name: 3-cyclopropyl-3-[[[ethyl-[[methyl(3-piperidinyl)amino]-oxomethyl]sulfonylamino]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclopropyl-3-[[ethyl-[methyl(piperidin-3-yl)carbamoyl]sulfonylcarbamoyl]amino]propanoic acid Traditional Name: 3-cyclopropyl-3-[[ethyl-[methyl(3-piperidyl)carbamoyl]sulfonyl-carbamoyl]amino]propionic acid Formula: C16H28N4O6S MolecularWeight: 404.48172

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)NC(CC(=O)O)C1CC1)S(=O)(=O)C(=O)N(C)C2CCCNC2

Isomeric SMILES

CCN(C(=O)NC(CC(=O)O)C1CC1)S(=O)(=O)C(=O)N(C)C2CCCNC2

InChI

InChI=1S/C16H28N4O6S/c1-3-20(15(23)18-13(9-14(21)22)11-6-7-11)27(25,26)16(24)19(2)12-5-4-8-17-10-12/h11-13,17H,3-10H2,1-2H3,(H,18,23)(H,21,22)