[(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [(2S)-1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: [(1S)-2-(4-ethylanilino)-1-methyl-2-oxo-ethyl]-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl]-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: [(1S)-2-(4-ethylanilino)-2-keto-1-methyl-ethyl]-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C17H23N2OS+ MolecularWeight: 303.44232

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)[NH2+]C(C)C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)[NH2+][C@H](C)C2=CC=CS2

InChI

InChI=1S/C17H22N2OS/c1-4-14-7-9-15(10-8-14)19-17(20)13(3)18-12(2)16-6-5-11-21-16/h5-13,18H,4H2,1-3H3,(H,19,20)/p+1/t12-,13+/m1/s1