methyl-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(1S)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-methyl-(3-thenyl)ammonium Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+](C)CC2=CSC=C2

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+](C)CC2=CSC=C2

InChI

InChI=1S/C16H19N3O2S/c1-17-16(21)18-15(20)14(13-6-4-3-5-7-13)19(2)10-12-8-9-22-11-12/h3-9,11,14H,10H2,1-2H3,(H2,17,18,20,21)/p+1/t14-/m0/s1