3-(4-tert-butylphenyl)-5-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-tert-butylphenyl)-5-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-tert-butylphenyl)-5-[(5-phenyloxazol-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-tert-butylphenyl)-5-[(5-phenyl-2-oxazolyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-tert-butylphenyl)-5-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(4-tert-butylphenyl)-5-[(5-phenyloxazol-2-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=NC=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=NC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5OS/c1-22(2,3)17-11-9-16(10-12-17)20-25-26-21(27(20)23)29-14-19-24-13-18(28-19)15-7-5-4-6-8-15/h4-13H,14,23H2,1-3H3