2-[[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-keto-2-(4-mesylpiperazino)ethyl]thio]methyl]-1H-quinazolin-4-one Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CSCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CSCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C16H20N4O4S2/c1-26(23,24)20-8-6-19(7-9-20)15(21)11-25-10-14-17-13-5-3-2-4-12(13)16(22)18-14/h2-5H,6-11H2,1H3,(H,17,18,22)