2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[2-[(4-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[2-[(4-fluorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H17FN4O2S2 MolecularWeight: 440.513683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4O2S2/c1-12-2-7-16-17(8-12)30-21(24-16)26-19(28)10-15-9-18(27)25-20(23-15)29-11-13-3-5-14(22)6-4-13/h2-9H,10-11H2,1H3,(H,23,25,27)(H,24,26,28)