2-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxo-ethyl]sulfanyl-6-isopropyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-ethyl-1-piperazin-4-iumyl)-2-oxoethyl]thio]-6-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)-2-oxoethyl]sulfanyl-6-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-ethylpiperazin-4-ium-1-yl)-2-keto-ethyl]thio]-6-isopropyl-1H-pyrimidin-4-one Formula: C15H25N4O2S+ MolecularWeight: 325.4496

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CSC2=NC(=O)C=C(N2)C(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CSC2=NC(=O)C=C(N2)C(C)C

InChI

InChI=1S/C15H24N4O2S/c1-4-18-5-7-19(8-6-18)14(21)10-22-15-16-12(11(2)3)9-13(20)17-15/h9,11H,4-8,10H2,1-3H3,(H,16,17,20)/p+1