N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide

Systemtic Name: N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide Openeye Name: N-[5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide CAS Name: N-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-3-methylbenzamide IUPAC Name: N-[5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-methylbenzamide Traditional Name: N-[5-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide Formula: C23H27N3OS2 MolecularWeight: 425.60998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC3=C(C=C(C=C3C)C(C)(C)C)C

InChI

InChI=1S/C23H27N3OS2/c1-14-8-7-9-17(10-14)20(27)24-21-25-26-22(29-21)28-13-19-15(2)11-18(12-16(19)3)23(4,5)6/h7-12H,13H2,1-6H3,(H,24,25,27)