5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ium-1-ylethanoylamino)thiophene-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ium-1-ylethanoylamino)thiophene-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-3-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]thiophene-2-carboxamide CAS Name: 5-(4-chlorophenyl)-3-[[1-oxo-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-2-thiophenecarboxamide IUPAC Name: 5-(4-chlorophenyl)-3-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]thiophene-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-3-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]thiophene-2-carboxamide Formula: C17H19ClN3O2S+ MolecularWeight: 364.86966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)N

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=C(SC(=C2)C3=CC=C(C=C3)Cl)C(=O)N

InChI

InChI=1S/C17H18ClN3O2S/c18-12-5-3-11(4-6-12)14-9-13(16(24-14)17(19)23)20-15(22)10-21-7-1-2-8-21/h3-6,9H,1-2,7-8,10H2,(H2,19,23)(H,20,22)/p+1