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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)F

InChI

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