[4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-(2-thienyl)methanone CAS Name: [4-(1H-indol-3-ylmethyl)-1-piperazin-4-iumyl]-thiophen-2-ylmethanone IUPAC Name: [4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(1H-indol-3-ylmethyl)piperazin-4-ium-1-yl]-(2-thienyl)methanone Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CNC3=CC=CC=C32)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CNC3=CC=CC=C32)C(=O)C4=CC=CS4

InChI

InChI=1S/C18H19N3OS/c22-18(17-6-3-11-23-17)21-9-7-20(8-10-21)13-14-12-19-16-5-2-1-4-15(14)16/h1-6,11-12,19H,7-10,13H2/p+1