N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide

Systemtic Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide Openeye Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide CAS Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-3-piperidin-1-iumyl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide IUPAC Name: N-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-3-yl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide Traditional Name: N-[(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-N-methyl-4H-thieno[3,2-b]pyrrole-5-carboxamide Formula: C22H26N3OS+ MolecularWeight: 380.52634

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=C(N4)C=CS5

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)C2CC3=CC=CC=C3C2)C(=O)C4=CC5=C(N4)C=CS5

InChI

InChI=1S/C22H25N3OS/c1-24(22(26)20-13-21-19(23-20)8-10-27-21)17-7-4-9-25(14-17)18-11-15-5-2-3-6-16(15)12-18/h2-3,5-6,8,10,13,17-18,23H,4,7,9,11-12,14H2,1H3/p+1/t17-/m0/s1