N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[2-[(4-fluorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]acetamide Formula: C23H21FN4O3S2 MolecularWeight: 484.566243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC=C(C=C4)F)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CC3=C(NC(=NC3=O)SCC4=CC=C(C=C4)F)C

InChI

InChI=1S/C23H21FN4O3S2/c1-3-31-16-8-9-18-19(10-16)33-23(26-18)27-20(29)11-17-13(2)25-22(28-21(17)30)32-12-14-4-6-15(24)7-5-14/h4-10H,3,11-12H2,1-2H3,(H,25,28,30)(H,26,27,29)