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

Systemtic Name: 5,6-dimethyl-2-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanyl-1H-pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]-5,6-dimethyl-1H-pyrimidin-4-one Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C20H17N3O2S2/c1-12-13(2)21-20(22-19(12)25)26-11-18(24)23-14-7-3-5-9-16(14)27-17-10-6-4-8-15(17)23/h3-10H,11H2,1-2H3,(H,21,22,25)