2-[3-[(1-cyclopentyl-4-methyl-piperidin-1-ium-1-yl)methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]-N-(1H-indol-4-ylmethyl)ethanamide

Systemtic Name: 2-[3-[(1-cyclopentyl-4-methyl-piperidin-1-ium-1-yl)methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]-N-(1H-indol-4-ylmethyl)ethanamide Openeye Name: 2-[3-[(1-cyclopentyl-4-methyl-piperidin-1-ium-1-yl)methylamino]-6-methyl-2-oxo-pyrazin-1-yl]-N-(1H-indol-4-ylmethyl)acetamide CAS Name: 2-[3-[(1-cyclopentyl-4-methyl-1-piperidin-1-iumyl)methylamino]-6-methyl-2-oxo-1-pyrazinyl]-N-(1H-indol-4-ylmethyl)acetamide IUPAC Name: 2-[3-[(1-cyclopentyl-4-methylpiperidin-1-ium-1-yl)methylamino]-6-methyl-2-oxopyrazin-1-yl]-N-(1H-indol-4-ylmethyl)acetamide Traditional Name: 2-[3-[(1-cyclopentyl-4-methyl-piperidin-1-ium-1-yl)methylamino]-2-keto-6-methyl-pyrazin-1-yl]-N-(1H-indol-4-ylmethyl)acetamide Formula: C28H39N6O2+ MolecularWeight: 491.64826

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](CC1)(CNC2=NC=C(N(C2=O)CC(=O)NCC3=C4C=CNC4=CC=C3)C)C5CCCC5

Isomeric SMILES

CC1CC[N+](CC1)(CNC2=NC=C(N(C2=O)CC(=O)NCC3=C4C=CNC4=CC=C3)C)C5CCCC5

InChI

InChI=1S/C28H38N6O2/c1-20-11-14-34(15-12-20,23-7-3-4-8-23)19-32-27-28(36)33(21(2)16-31-27)18-26(35)30-17-22-6-5-9-25-24(22)10-13-29-25/h5-6,9-10,13,16,20,23,29H,3-4,7-8,11-12,14-15,17-19H2,1-2H3,(H-,30,31,32,35)/p+1