(5-chloranylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-ethyl-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl]azanium Openeye Name: [2-(benzylcarbamoylamino)-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]-ethyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-ethyl-[2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]ammonium IUPAC Name: [2-(benzylcarbamoylamino)-2-oxoethyl]-[(5-chlorothiophen-2-yl)methyl]-ethylazanium Traditional Name: [2-(benzylcarbamoylamino)-2-keto-ethyl]-[(5-chloro-2-thienyl)methyl]-ethyl-ammonium Formula: C17H21ClN3O2S+ MolecularWeight: 366.88554

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H20ClN3O2S/c1-2-21(11-14-8-9-15(18)24-14)12-16(22)20-17(23)19-10-13-6-4-3-5-7-13/h3-9H,2,10-12H2,1H3,(H2,19,20,22,23)/p+1