3-(2-methylphenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-(2-methylphenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-(o-tolyl)-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-(2-methylphenyl)-5-[(5-phenyl-3-isoxazolyl)methylthio]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-(2-methylphenyl)-5-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-(o-tolyl)-5-[(5-phenylisoxazol-3-yl)methylthio]-1,3,4-thiadiazole-2-thione Formula: C19H15N3OS3 MolecularWeight: 397.5369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=S)SC(=N2)SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3OS3/c1-13-7-5-6-10-16(13)22-19(24)26-18(20-22)25-12-15-11-17(23-21-15)14-8-3-2-4-9-14/h2-11H,12H2,1H3