5-[5-tert-butyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3H-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-[5-tert-butyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3H-1,3,4-oxadiazole-2-thione Openeye Name: 5-[5-tert-butyl-2-(m-tolylmethyl)pyrazol-3-yl]-3H-1,3,4-oxadiazole-2-thione CAS Name: 5-[5-tert-butyl-2-[(3-methylphenyl)methyl]-3-pyrazolyl]-3H-1,3,4-oxadiazole-2-thione IUPAC Name: 5-[5-tert-butyl-2-[(3-methylphenyl)methyl]pyrazol-3-yl]-3H-1,3,4-oxadiazole-2-thione Traditional Name: 5-[5-tert-butyl-2-(3-methylbenzyl)pyrazol-3-yl]-3H-1,3,4-oxadiazole-2-thione Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C(=CC(=N2)C(C)(C)C)C3=NNC(=S)O3

Isomeric SMILES

CC1=CC(=CC=C1)CN2C(=CC(=N2)C(C)(C)C)C3=NNC(=S)O3

InChI

InChI=1S/C17H20N4OS/c1-11-6-5-7-12(8-11)10-21-13(15-18-19-16(23)22-15)9-14(20-21)17(2,3)4/h5-9H,10H2,1-4H3,(H,19,23)