N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(phenylmethyl)thieno[3,2-b]pyrrole-5-carboxamide

Systemtic Name: N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-4-(phenylmethyl)thieno[3,2-b]pyrrole-5-carboxamide Openeye Name: 4-benzyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thieno[3,2-b]pyrrole-5-carboxamide CAS Name: N-[3-(4-methyl-1-piperidin-1-iumyl)propyl]-4-(phenylmethyl)-5-thieno[3,2-b]pyrrolecarboxamide IUPAC Name: 4-benzyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thieno[3,2-b]pyrrole-5-carboxamide Traditional Name: 4-benzyl-N-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thieno[3,2-b]pyrrole-5-carboxamide Formula: C23H30N3OS+ MolecularWeight: 396.5688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=O)C2=CC3=C(N2CC4=CC=CC=C4)C=CS3

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=O)C2=CC3=C(N2CC4=CC=CC=C4)C=CS3

InChI

InChI=1S/C23H29N3OS/c1-18-8-13-25(14-9-18)12-5-11-24-23(27)21-16-22-20(10-15-28-22)26(21)17-19-6-3-2-4-7-19/h2-4,6-7,10,15-16,18H,5,8-9,11-14,17H2,1H3,(H,24,27)/p+1