1-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-5-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 1-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxidanylidene-oxolan-3-yl]amino]-5-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 1-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxo-tetrahydrofuran-3-yl]amino]-5-methylsulfanyl-pyrazole-4-carbonitrile CAS Name: 1-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxo-3-oxolanyl]amino]-5-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 1-[[5-(2,5-dimethoxyphenyl)-5-methyl-2-oxooxolan-3-yl]amino]-5-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 1-[[5-(2,5-dimethoxyphenyl)-2-keto-5-methyl-tetrahydrofuran-3-yl]amino]-5-(methylthio)pyrazole-4-carbonitrile Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NN2C(=C(C=N2)C#N)SC)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1(CC(C(=O)O1)NN2C(=C(C=N2)C#N)SC)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C18H20N4O4S/c1-18(13-7-12(24-2)5-6-15(13)25-3)8-14(17(23)26-18)21-22-16(27-4)11(9-19)10-20-22/h5-7,10,14,21H,8H2,1-4H3