5-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[4-(6-methyl-2-propan-2-yl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[[4-(6-methyl-2-propan-2-yl-4-pyrimidin-3-iumyl)-1-piperazinyl]sulfonyl]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[4-(6-methyl-2-propan-2-ylpyrimidin-3-ium-4-yl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[4-(2-isopropyl-6-methyl-pyrimidin-3-ium-4-yl)piperazino]sulfonyl-1,3-dihydrobenzimidazol-2-one Formula: C19H25N6O3S+ MolecularWeight: 417.5052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C(C)C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C19H24N6O3S/c1-12(2)18-20-13(3)10-17(23-18)24-6-8-25(9-7-24)29(27,28)14-4-5-15-16(11-14)22-19(26)21-15/h4-5,10-12H,6-9H2,1-3H3,(H2,21,22,26)/p+1