(4-aminocarbonylphenyl)methyl-cyclopropyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-cyclopropyl-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]azanium Openeye Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-oxo-2-(2-thienylmethylamino)ethyl]ammonium CAS Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]ammonium IUPAC Name: (4-carbamoylphenyl)methyl-cyclopropyl-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]azanium Traditional Name: (4-carbamoylbenzyl)-cyclopropyl-[2-keto-2-(2-thenylamino)ethyl]ammonium Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=C(C=C2)C(=O)N)CC(=O)NCC3=CC=CS3

Isomeric SMILES

C1CC1[NH+](CC2=CC=C(C=C2)C(=O)N)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C18H21N3O2S/c19-18(23)14-5-3-13(4-6-14)11-21(15-7-8-15)12-17(22)20-10-16-2-1-9-24-16/h1-6,9,15H,7-8,10-12H2,(H2,19,23)(H,20,22)/p+1