2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[7-(4-fluorophenyl)-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[7-(4-fluorophenyl)-2,4-diketo-1,3-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl]thio]-N-(m-tolyl)acetamide Formula: C23H20FN5O3S MolecularWeight: 465.500003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN5O3S/c1-13-5-4-6-16(11-13)25-17(30)12-33-21-18-20(28(2)23(32)29(3)22(18)31)26-19(27-21)14-7-9-15(24)10-8-14/h4-11H,12H2,1-3H3,(H,25,30)