[5-(4,6-dimethoxy-2-methylsulfanyl-pyrimidin-5-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [5-(4,6-dimethoxy-2-methylsulfanyl-pyrimidin-5-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] 2,2-dimethylpropanoate Openeye Name: [5-(4,6-dimethoxy-2-methylsulfanyl-pyrimidin-5-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxo-cyclohexen-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [5-[4,6-dimethoxy-2-(methylthio)-5-pyrimidinyl]-2-[(1Z)-1-ethoxyiminobutyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(4,6-dimethoxy-2-methylsulfanylpyrimidin-5-yl)-2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-3-oxocyclohexen-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-[4,6-dimethoxy-2-(methylthio)pyrimidin-5-yl]-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-keto-cyclohexen-1-yl] ester Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NOCC)C1=C(CC(CC1=O)C2=C(N=C(N=C2OC)SC)OC)OC(=O)C(C)(C)C

Isomeric SMILES

CCC/C(=N/OCC)/C1=C(CC(CC1=O)C2=C(N=C(N=C2OC)SC)OC)OC(=O)C(C)(C)C

InChI

InChI=1S/C24H35N3O6S/c1-9-11-15(27-32-10-2)19-16(28)12-14(13-17(19)33-22(29)24(3,4)5)18-20(30-6)25-23(34-8)26-21(18)31-7/h14H,9-13H2,1-8H3/b27-15-