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

Systemtic Name: N-(3-methylphenyl)-2-(2-pyrrolidin-1-ium-1-ylethanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: N-(m-tolyl)-2-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: N-(3-methylphenyl)-2-[[1-oxo-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: N-(3-methylphenyl)-2-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: N-(m-tolyl)-2-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)C[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=C(SC3=C2CCC3)NC(=O)C[NH+]4CCCC4

InChI

InChI=1S/C21H25N3O2S/c1-14-6-4-7-15(12-14)22-20(26)19-16-8-5-9-17(16)27-21(19)23-18(25)13-24-10-2-3-11-24/h4,6-7,12H,2-3,5,8-11,13H2,1H3,(H,22,26)(H,23,25)/p+1