2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxo-ethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-keto-ethyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCSC3=CC=CC=C32

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)N2CCSC3=CC=CC=C32

InChI

InChI=1S/C17H19N3O2S2/c1-2-5-12-10-15(21)19-17(18-12)24-11-16(22)20-8-9-23-14-7-4-3-6-13(14)20/h3-4,6-7,10H,2,5,8-9,11H2,1H3,(H,18,19,21)