6-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide

Systemtic Name: 6-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide Openeye Name: 6-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-N-[3-(2-isopropyl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide CAS Name: 6-[(3S)-3,4-dimethyl-1-piperazin-4-iumyl]-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]-3-pyridinecarboxamide IUPAC Name: 6-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide Traditional Name: 6-[(3S)-3,4-dimethylpiperazin-4-ium-1-yl]-N-[3-(2-isopropyl-1H-imidazol-3-ium-3-yl)propyl]nicotinamide Formula: C21H34N6O+2 MolecularWeight: 386.53426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH+]1C)C2=NC=C(C=C2)C(=O)NCCC[N+]3=C(NC=C3)C(C)C

Isomeric SMILES

C[C@H]1CN(CC[NH+]1C)C2=NC=C(C=C2)C(=O)NCCC[N+]3=C(NC=C3)C(C)C

InChI

InChI=1S/C21H32N6O/c1-16(2)20-22-9-11-26(20)10-5-8-23-21(28)18-6-7-19(24-14-18)27-13-12-25(4)17(3)15-27/h6-7,9,11,14,16-17H,5,8,10,12-13,15H2,1-4H3,(H,23,28)/p+2/t17-/m0/s1