6-[(4-chloranylphenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Systemtic Name: 6-[(4-chloranylphenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Openeye Name: 6-[(4-chlorophenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole CAS Name: 6-[(4-chlorophenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole IUPAC Name: 6-[(4-chlorophenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Traditional Name: 6-[(4-chlorophenoxy)methyl]-3-[(2,5-dimethylphenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Formula: C19H17ClN4O2S MolecularWeight: 400.88188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=NN=C3N2N=C(S3)COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=NN=C3N2N=C(S3)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H17ClN4O2S/c1-12-3-4-13(2)16(9-12)26-10-17-21-22-19-24(17)23-18(27-19)11-25-15-7-5-14(20)6-8-15/h3-9H,10-11H2,1-2H3