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

Systemtic Name: 6-(4-methyl-1,4-diazepan-1-yl)-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide Openeye Name: N-[3-(2-isopropyl-1H-imidazol-3-ium-3-yl)propyl]-6-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carboxamide CAS Name: 6-(4-methyl-1,4-diazepan-1-yl)-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-methyl-1,4-diazepan-1-yl)-N-[3-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)propyl]pyridine-3-carboxamide Traditional Name: N-[3-(2-isopropyl-1H-imidazol-3-ium-3-yl)propyl]-6-(4-methyl-1,4-diazepan-1-yl)nicotinamide Formula: C21H33N6O+ MolecularWeight: 385.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CCCNC(=O)C2=CN=C(C=C2)N3CCCN(CC3)C

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CCCNC(=O)C2=CN=C(C=C2)N3CCCN(CC3)C

InChI

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