cyclohexyl-methyl-[(1R)-2-oxidanylidene-2-piperazin-1-yl-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: cyclohexyl-methyl-[(1R)-2-oxidanylidene-2-piperazin-1-yl-1-thiophen-2-yl-ethyl]azanium Openeye Name: cyclohexyl-methyl-[(1R)-2-oxo-2-piperazin-1-yl-1-(2-thienyl)ethyl]ammonium CAS Name: cyclohexyl-methyl-[(1R)-2-oxo-2-(1-piperazinyl)-1-thiophen-2-ylethyl]ammonium IUPAC Name: cyclohexyl-methyl-[(1R)-2-oxo-2-piperazin-1-yl-1-thiophen-2-ylethyl]azanium Traditional Name: cyclohexyl-[(1R)-2-keto-2-piperazino-1-(2-thienyl)ethyl]-methyl-ammonium Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C(C2=CC=CS2)C(=O)N3CCNCC3

Isomeric SMILES

C[NH+](C1CCCCC1)[C@@H](C2=CC=CS2)C(=O)N3CCNCC3

InChI

InChI=1S/C17H27N3OS/c1-19(14-6-3-2-4-7-14)16(15-8-5-13-22-15)17(21)20-11-9-18-10-12-20/h5,8,13-14,16,18H,2-4,6-7,9-12H2,1H3/p+1/t16-/m0/s1