3-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-isopropylphenoxy)methyl]-5-[(5-phenylisoxazol-3-yl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(5-phenyl-3-isoxazolyl)methylthio]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-isopropylphenoxy)methyl]-5-[(5-phenylisoxazol-3-yl)methylthio]-1,2,4-triazol-4-yl]amine Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=NOC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=NOC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2S/c1-15(2)16-8-10-19(11-9-16)28-13-21-24-25-22(27(21)23)30-14-18-12-20(29-26-18)17-6-4-3-5-7-17/h3-12,15H,13-14,23H2,1-2H3