(5-chloranylthiophen-2-yl)methyl-methyl-[2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-methyl-[2-oxidanylidene-2-[[(2S)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium Openeye Name: [2-[[(1S)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-methyl-[2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-methyl-[2-oxo-2-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]azanium Traditional Name: [2-[[(1S)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium Formula: C18H22ClN2O2S+ MolecularWeight: 365.89748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Cl

Isomeric SMILES

CC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C18H21ClN2O2S/c1-13(22)16(10-14-6-4-3-5-7-14)20-18(23)12-21(2)11-15-8-9-17(19)24-15/h3-9,16H,10-12H2,1-2H3,(H,20,23)/p+1/t16-/m0/s1