3-(4-tert-butylphenyl)-6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Systemtic Name: 3-(4-tert-butylphenyl)-6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Openeye Name: 3-(4-tert-butylphenyl)-6-(3-pyridyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole CAS Name: 3-(4-tert-butylphenyl)-6-(3-pyridinyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole IUPAC Name: 3-(4-tert-butylphenyl)-6-pyridin-3-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Traditional Name: 3-(4-tert-butylphenyl)-6-(3-pyridyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CN=CC=C4

InChI

InChI=1S/C18H17N5S/c1-18(2,3)14-8-6-12(7-9-14)15-20-21-17-23(15)22-16(24-17)13-5-4-10-19-11-13/h4-11H,1-3H3