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

Systemtic Name: 6-(4-tert-butylphenyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Openeye Name: 6-(4-tert-butylphenyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole CAS Name: 6-(4-tert-butylphenyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole IUPAC Name: 6-(4-tert-butylphenyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Traditional Name: 6-(4-tert-butylphenyl)-3-(4-chlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole Formula: C19H17ClN4S MolecularWeight: 368.88308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H17ClN4S/c1-19(2,3)14-8-4-13(5-9-14)17-23-24-16(21-22-18(24)25-17)12-6-10-15(20)11-7-12/h4-11H,1-3H3