2-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Formula: C20H23N4O2S+ MolecularWeight: 383.48722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2S/c21-19(26)15-7-10-27-20(15)23-18(25)12-24-8-5-13(6-9-24)16-11-22-17-4-2-1-3-14(16)17/h1-4,7,10-11,13,22H,5-6,8-9,12H2,(H2,21,26)(H,23,25)/p+1