N-(3-cyanothiophen-2-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetamide Formula: C20H21N4OS+ MolecularWeight: 365.47194

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)NC4=C(C=CS4)C#N

Isomeric SMILES

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)NC4=C(C=CS4)C#N

InChI

InChI=1S/C20H20N4OS/c21-11-15-7-10-26-20(15)23-19(25)13-24-8-5-14(6-9-24)17-12-22-18-4-2-1-3-16(17)18/h1-4,7,10,12,14,22H,5-6,8-9,13H2,(H,23,25)/p+1