N-[3-(1H-indol-2-yl)phenyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(1H-indol-2-yl)phenyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[3-(1H-indol-2-yl)phenyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-4-carboxamide CAS Name: N-[3-(1H-indol-2-yl)phenyl]-1-[3-(methylthio)propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(1H-indol-2-yl)phenyl]-1-(3-methylsulfanylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: N-[3-(1H-indol-2-yl)phenyl]-1-[3-(methylthio)propyl]piperidin-1-ium-4-carboxamide Formula: C24H30N3OS+ MolecularWeight: 408.5795

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH+]1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CSCCC[NH+]1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C24H29N3OS/c1-29-15-5-12-27-13-10-18(11-14-27)24(28)25-21-8-4-7-19(16-21)23-17-20-6-2-3-9-22(20)26-23/h2-4,6-9,16-18,26H,5,10-15H2,1H3,(H,25,28)/p+1