5-ethyl-6-methyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-methyl-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1H-pyrimidin-4-one Traditional Name: 5-ethyl-2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-6-methyl-1H-pyrimidin-4-one Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C21H19N3O2S2/c1-3-14-13(2)22-21(23-20(14)26)27-12-19(25)24-15-8-4-6-10-17(15)28-18-11-7-5-9-16(18)24/h4-11H,3,12H2,1-2H3,(H,22,23,26)