2-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-3-nitro-imidazo[1,2-a]pyridine

Systemtic Name: 2-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-3-nitro-imidazo[1,2-a]pyridine Openeye Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]-3-nitro-imidazo[1,2-a]pyridine CAS Name: 2-[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]-3-nitroimidazo[1,2-a]pyridine IUPAC Name: 2-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]-3-nitroimidazo[1,2-a]pyridine Traditional Name: 2-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]-3-nitro-imidazo[1,2-a]pyridine Formula: C19H24N7O2+ MolecularWeight: 382.43956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=C(N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)C3=C(N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N7O2/c1-13(2)17-20-14(3)12-16(21-17)23-8-10-24(11-9-23)18-19(26(27)28)25-7-5-4-6-15(25)22-18/h4-7,12-13H,8-11H2,1-3H3/p+1