2-(4-ethylpiperazin-4-ium-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-pyrimidin-4-one Openeye Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-pyrimidin-4-one CAS Name: 2-(4-ethyl-1-piperazin-4-iumyl)-6-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1H-pyrimidin-4-one Traditional Name: 2-(4-ethylpiperazin-4-ium-1-yl)-6-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-1H-pyrimidin-4-one Formula: C14H21N6OS2+ MolecularWeight: 353.48614

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=C(S3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=C(S3)C

InChI

InChI=1S/C14H20N6OS2/c1-3-19-4-6-20(7-5-19)13-15-11(8-12(21)16-13)9-22-14-18-17-10(2)23-14/h8H,3-7,9H2,1-2H3,(H,15,16,21)/p+1