5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile

Systemtic Name: 5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile Openeye Name: 5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile CAS Name: 5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile IUPAC Name: 5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile Traditional Name: 5-(3,4,5-trimethoxyphenyl)-1,3,4-thiadiazole-2-carbonitrile Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(S2)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(S2)C#N

InChI

InChI=1S/C12H11N3O3S/c1-16-8-4-7(5-9(17-2)11(8)18-3)12-15-14-10(6-13)19-12/h4-5H,1-3H3