tert-butyl-[3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]propyl]azanium

Systemtic Name: tert-butyl-[3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]propyl]azanium Openeye Name: tert-butyl-[3-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]propyl]ammonium CAS Name: tert-butyl-[3-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]propyl]ammonium IUPAC Name: tert-butyl-[3-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]propyl]azanium Traditional Name: tert-butyl-[3-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]propyl]ammonium Formula: C17H30N3O3S2+ MolecularWeight: 388.5684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)[NH2+]CCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H29N3O3S2/c1-17(2,3)19-10-5-9-18-16(21)14-7-11-20(12-8-14)25(22,23)15-6-4-13-24-15/h4,6,13-14,19H,5,7-12H2,1-3H3,(H,18,21)/p+1