3-[(3-tert-butyl-4-oxidanyl-phenyl)methyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-[(3-tert-butyl-4-oxidanyl-phenyl)methyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Openeye Name: 3-[(3-tert-butyl-4-hydroxy-phenyl)methyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione CAS Name: 3-[(3-tert-butyl-4-hydroxyphenyl)methyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[(3-tert-butyl-4-hydroxyphenyl)methyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Traditional Name: 3-(3-tert-butyl-4-hydroxy-benzyl)-5-(4-chlorophenyl)-1,3,4-thiadiazole-2-thione Formula: C19H19ClN2OS2 MolecularWeight: 390.94996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)CN2C(=S)SC(=N2)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)CN2C(=S)SC(=N2)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C19H19ClN2OS2/c1-19(2,3)15-10-12(4-9-16(15)23)11-22-18(24)25-17(21-22)13-5-7-14(20)8-6-13/h4-10,23H,11H2,1-3H3