[(1S)-2-[(4-tert-butylcyclohexyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-tert-butylcyclohexyl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-tert-butylcyclohexanecarbonyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-tert-butylcyclohexyl)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-tert-butylcyclohexanecarbonyl)amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-tert-butylcyclohexanecarbonyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C19H33N2OS+ MolecularWeight: 337.54312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)NCC(C2=CSC=C2)[NH+](C)C

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)NC[C@H](C2=CSC=C2)[NH+](C)C

InChI

InChI=1S/C19H32N2OS/c1-19(2,3)16-8-6-14(7-9-16)18(22)20-12-17(21(4)5)15-10-11-23-13-15/h10-11,13-14,16-17H,6-9,12H2,1-5H3,(H,20,22)/p+1/t14?,16?,17-/m1/s1