4-(3-chloranyl-4,5-dimethoxy-phenyl)-1,3-thiazole-2-carbonitrile

Systemtic Name: 4-(3-chloranyl-4,5-dimethoxy-phenyl)-1,3-thiazole-2-carbonitrile Openeye Name: 4-(3-chloro-4,5-dimethoxy-phenyl)thiazole-2-carbonitrile CAS Name: 4-(3-chloro-4,5-dimethoxyphenyl)-2-thiazolecarbonitrile IUPAC Name: 4-(3-chloro-4,5-dimethoxyphenyl)-1,3-thiazole-2-carbonitrile Traditional Name: 4-(3-chloro-4,5-dimethoxy-phenyl)thiazole-2-carbonitrile Formula: C12H9ClN2O2S MolecularWeight: 280.73006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2=CSC(=N2)C#N)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C2=CSC(=N2)C#N)Cl)OC

InChI

InChI=1S/C12H9ClN2O2S/c1-16-10-4-7(3-8(13)12(10)17-2)9-6-18-11(5-14)15-9/h3-4,6H,1-2H3