N-(4-chlorophenyl)-2-(2-piperidin-1-ium-1-ylethanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-(2-piperidin-1-ium-1-ylethanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: N-(4-chlorophenyl)-2-[(2-piperidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: N-(4-chlorophenyl)-2-[[1-oxo-2-(1-piperidin-1-iumyl)ethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: N-(4-chlorophenyl)-2-[(2-piperidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: N-(4-chlorophenyl)-2-[(2-piperidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C21H25ClN3O2S+ MolecularWeight: 418.9601

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCC3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCC3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H24ClN3O2S/c22-14-7-9-15(10-8-14)23-20(27)19-16-5-4-6-17(16)28-21(19)24-18(26)13-25-11-2-1-3-12-25/h7-10H,1-6,11-13H2,(H,23,27)(H,24,26)/p+1