4-[6-methyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)pyrimidin-3-ium-4-yl]morpholine

Systemtic Name: 4-[6-methyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)pyrimidin-3-ium-4-yl]morpholine Openeye Name: 4-[6-methyl-2-[4-(2-thienylsulfonyl)piperazin-1-yl]pyrimidin-3-ium-4-yl]morpholine CAS Name: 4-[6-methyl-2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-4-pyrimidin-3-iumyl]morpholine IUPAC Name: 4-[6-methyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)pyrimidin-3-ium-4-yl]morpholine Traditional Name: 4-[6-methyl-2-[4-(2-thienylsulfonyl)piperazino]pyrimidin-3-ium-4-yl]morpholine Formula: C17H24N5O3S2+ MolecularWeight: 410.53416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)N4CCOCC4

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)N4CCOCC4

InChI

InChI=1S/C17H23N5O3S2/c1-14-13-15(20-8-10-25-11-9-20)19-17(18-14)21-4-6-22(7-5-21)27(23,24)16-3-2-12-26-16/h2-3,12-13H,4-11H2,1H3/p+1