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

Systemtic Name: methyl-[(1R)-2-oxidanylidene-2-piperazin-1-yl-1-thiophen-2-yl-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(1R)-2-oxo-2-piperazin-1-yl-1-(2-thienyl)ethyl]ammonium CAS Name: methyl-[(1R)-2-oxo-2-(1-piperazinyl)-1-thiophen-2-ylethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(1R)-2-oxo-2-piperazin-1-yl-1-thiophen-2-ylethyl]azanium Traditional Name: benzyl-[(1R)-2-keto-2-piperazino-1-(2-thienyl)ethyl]-methyl-ammonium Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C(C2=CC=CS2)C(=O)N3CCNCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@@H](C2=CC=CS2)C(=O)N3CCNCC3

InChI

InChI=1S/C18H23N3OS/c1-20(14-15-6-3-2-4-7-15)17(16-8-5-13-23-16)18(22)21-11-9-19-10-12-21/h2-8,13,17,19H,9-12,14H2,1H3/p+1/t17-/m0/s1