N-[(2-methylpropan-2-yl)oxy]-4-[2-(pyridin-3-ylsulfonylamino)ethylsulfonyl]piperazine-2-carboxamide dihydrochloride

Systemtic Name: N-[(2-methylpropan-2-yl)oxy]-4-[2-(pyridin-3-ylsulfonylamino)ethylsulfonyl]piperazine-2-carboxamide dihydrochloride Openeye Name: N-tert-butoxy-4-[2-(3-pyridylsulfonylamino)ethylsulfonyl]piperazine-2-carboxamide dihydrochloride CAS Name: N-[(2-methylpropan-2-yl)oxy]-4-[2-(3-pyridinylsulfonylamino)ethylsulfonyl]-2-piperazinecarboxamide dihydrochloride IUPAC Name: N-[(2-methylpropan-2-yl)oxy]-4-[2-(pyridin-3-ylsulfonylamino)ethylsulfonyl]piperazine-2-carboxamide dihydrochloride Traditional Name: N-tert-butoxy-4-[2-(3-pyridylsulfonylamino)ethylsulfonyl]piperazine-2-carboxamide dihydrochloride Formula: C16H29Cl2N5O6S2 MolecularWeight: 522.46736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ONC(=O)C1CN(CCN1)S(=O)(=O)CCNS(=O)(=O)C2=CN=CC=C2.Cl.Cl

Isomeric SMILES

CC(C)(C)ONC(=O)C1CN(CCN1)S(=O)(=O)CCNS(=O)(=O)C2=CN=CC=C2.Cl.Cl

InChI

InChI=1S/C16H27N5O6S2.2ClH/c1-16(2,3)27-20-15(22)14-12-21(9-7-18-14)28(23,24)10-8-19-29(25,26)13-5-4-6-17-11-13;;/h4-6,11,14,18-19H,7-10,12H2,1-3H3,(H,20,22);2*1H